N-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide

C16H26N2O2 — CID 110204016

IUPACN-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide
SMILESCC(C)N1C(=O)C2(CCCCC2)C1C(=O)NCC1CC1
InChIInChI=1S/C16H26N2O2/c1-11(2)18-13(14(19)17-10-12-6-7-12)16(15(18)20)8-4-3-5-9-16/h11-13H,3-10H2,1-2H3,(H,17,19)
InChIKeyRMSDBTXWNIFELS-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.08
Rot. Bonds4

About N-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide

N-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide (PubChem CID 110204016) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide
PubChem CID110204016
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide
SMILESCC(C)N1C(=O)C2(CCCCC2)C1C(=O)NCC1CC1
InChIInChI=1S/C16H26N2O2/c1-11(2)18-13(14(19)17-10-12-6-7-12)16(15(18)20)8-4-3-5-9-16/h11-13H,3-10H2,1-2H3,(H,17,19)
InChIKeyRMSDBTXWNIFELS-UHFFFAOYSA-N
XLogP2.08
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide (CID 110204016) is N-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide is CC(C)N1C(=O)C2(CCCCC2)C1C(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide?
The InChIKey is RMSDBTXWNIFELS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-11(2)18-13(14(19)17-10-12-6-7-12)16(15(18)20)8-4-3-5-9-16/h11-13H,3-10H2,1-2H3,(H,17,19).
What are the key properties of N-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide?
N-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-3-oxo-2-propan-2-yl-2-azaspiro[3.5]nonane-1-carboxamide is sourced from PubChem (CID 110204016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).