N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide

C14H25N3O2 — CID 112547931

IUPACN-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide
SMILESCC(C)CNC(=O)CNC(=O)C1CC12CCNCC2
InChIInChI=1S/C14H25N3O2/c1-10(2)8-16-12(18)9-17-13(19)11-7-14(11)3-5-15-6-4-14/h10-11,15H,3-9H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyVCCBJORINASYDH-UHFFFAOYSA-N
MW267.37 g/mol
LogP0.26
Rot. Bonds5

About N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide

N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide (PubChem CID 112547931) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide
PubChem CID112547931
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC NameN-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide
SMILESCC(C)CNC(=O)CNC(=O)C1CC12CCNCC2
InChIInChI=1S/C14H25N3O2/c1-10(2)8-16-12(18)9-17-13(19)11-7-14(11)3-5-15-6-4-14/h10-11,15H,3-9H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyVCCBJORINASYDH-UHFFFAOYSA-N
XLogP0.26
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromoprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide
CID 115868385
N-(2-chloroprop-2-enyl)-6-azaspiro[2.5]octane-2-carboxamide
CID 115868404
N-(2-hydroxy-2-methylpropyl)-6-azaspiro[2.5]octane-2-carboxamide
CID 65107462
5-(6-azaspiro[2.5]octane-2-carbonylamino)-2-methylpentanoic acid
CID 104685675
N-[2-(dimethylcarbamoylamino)ethyl]-6-azaspiro[2.5]octane-2-carboxamide
CID 83110512
N-propan-2-ylsulfonyl-6-azaspiro[2.5]octane-2-carboxamide
CID 103308054
(2S)-N-[2-(2-methylpropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 103796173
N-[[1-(methoxymethyl)cyclobutyl]methyl]-6-azaspiro[2.5]octane-2-carboxamide;hydrochloride
CID 154909189
1-[2-(2,9-diazaspiro[5.5]undecan-5-yl)-2-oxoethyl]-3-(2-methylpropyl)urea
CID 154021172
N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-6-azaspiro[2.5]octane-2-carboxamide
CID 114756868
N-[3-(methanesulfonamido)propyl]-6-azaspiro[2.5]octane-2-carboxamide
CID 103872583
N-[(4-ethylphenyl)methyl]-6-azaspiro[2.5]octane-2-carboxamide
CID 103872581

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide?
The IUPAC name of N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide (CID 112547931) is N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide.
What is the SMILES notation for N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide?
The canonical SMILES for N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide is CC(C)CNC(=O)CNC(=O)C1CC12CCNCC2.
What is the InChIKey of N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide?
The InChIKey is VCCBJORINASYDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-10(2)8-16-12(18)9-17-13(19)11-7-14(11)3-5-15-6-4-14/h10-11,15H,3-9H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide?
N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide has a molecular weight of 267.37 g/mol, XLogP of 0.26, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylpropylamino)-2-oxoethyl]-6-azaspiro[2.5]octane-2-carboxamide is sourced from PubChem (CID 112547931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).