9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide

C20H34N4O2 — CID 118742190

IUPAC9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide
SMILESCCN1CCC2(CN(C(=O)N(C)C)CC23CCN(CC2CC2)CC3)C1=O
InChIInChI=1S/C20H34N4O2/c1-4-23-12-9-20(17(23)25)15-24(18(26)21(2)3)14-19(20)7-10-22(11-8-19)13-16-5-6-16/h16H,4-15H2,1-3H3
InChIKeyJPDOVCBPAGDFAD-UHFFFAOYSA-N
MW362.52 g/mol
LogP1.71
Rot. Bonds3

About 9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide

9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide (PubChem CID 118742190) has the molecular formula C20H34N4O2 and a molecular weight of 362.52 g/mol. Its IUPAC name is 9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide.

Molecular Properties

Compound Name9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide
PubChem CID118742190
Molecular FormulaC20H34N4O2
Molecular Weight362.52 g/mol
Exact Mass362.27
IUPAC Name9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide
SMILESCCN1CCC2(CN(C(=O)N(C)C)CC23CCN(CC2CC2)CC3)C1=O
InChIInChI=1S/C20H34N4O2/c1-4-23-12-9-20(17(23)25)15-24(18(26)21(2)3)14-19(20)7-10-22(11-8-19)13-16-5-6-16/h16H,4-15H2,1-3H3
InChIKeyJPDOVCBPAGDFAD-UHFFFAOYSA-N
XLogP1.71
TPSA47.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.52
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3aS,6aR)-N,N,2-trimethyl-1'-(3-methylbutanoyl)-1-oxospiro[3a,4,6,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,4'-piperidine]-5-carboxamide
CID 97439162
13-acetyl-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide
CID 118738723
13-Acetyl-9-(cyclopropylmethyl)-3-ethyl-3,9,13-triazadispiro[4.0.56.35]tetradecan-4-one
CID 118742195
3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.5^{6}.3^{5}]tetradecane-13-carboxamide
CID 118742205
13-(cyclopropylmethyl)-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-9-carboxamide
CID 118742280
7-Methyl-2-(1-pyrrolidinylcarbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72891357
9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide;2,2,2-trifluoroacetic acid
CID 118742189
9-(1-Fluorocyclopropanecarbonyl)-3-methyl-13-(2-methylpropyl)-3,9,13-triazadispiro[4.0.56.35]tetradecan-4-one
CID 131685038
13-Acetyl-3-ethyl-9-(1-fluorocyclopropanecarbonyl)-3,9,13-triazadispiro[4.0.56.35]tetradecan-4-one
CID 131688492
2-(Cyclopropylmethyl)-8-(pyrrolidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one
CID 97370287
9-(Cyclopropylmethyl)-3-ethyl-13-(2-methoxyethyl)-3,9,13-triazadispiro[4.0.56.35]tetradecan-4-one
CID 131641826
9-(dimethylsulfamoyl)-N,N,3-trimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide
CID 134074518

Frequently Asked Questions

What is the IUPAC name of 9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide?
The IUPAC name of 9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide (CID 118742190) is 9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide.
What is the SMILES notation for 9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide?
The canonical SMILES for 9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide is CCN1CCC2(CN(C(=O)N(C)C)CC23CCN(CC2CC2)CC3)C1=O.
What is the InChIKey of 9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide?
The InChIKey is JPDOVCBPAGDFAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H34N4O2/c1-4-23-12-9-20(17(23)25)15-24(18(26)21(2)3)14-19(20)7-10-22(11-8-19)13-16-5-6-16/h16H,4-15H2,1-3H3.
What are the key properties of 9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide?
9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide has a molecular weight of 362.52 g/mol, XLogP of 1.71, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(cyclopropylmethyl)-3-ethyl-N,N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-13-carboxamide is sourced from PubChem (CID 118742190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).