3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide

C16H29N3O — CID 62931119

IUPAC3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide
SMILESNC(=O)C(CN1CCC2(CCCCC2)CC1)NC1CC1
InChIInChI=1S/C16H29N3O/c17-15(20)14(18-13-4-5-13)12-19-10-8-16(9-11-19)6-2-1-3-7-16/h13-14,18H,1-12H2,(H2,17,20)
InChIKeyLPIHTDNBXAIXPE-UHFFFAOYSA-N
MW279.43 g/mol
LogP1.64
Rot. Bonds5

About 3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide

3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide (PubChem CID 62931119) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is 3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide.

Molecular Properties

Compound Name3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide
PubChem CID62931119
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC Name3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide
SMILESNC(=O)C(CN1CCC2(CCCCC2)CC1)NC1CC1
InChIInChI=1S/C16H29N3O/c17-15(20)14(18-13-4-5-13)12-19-10-8-16(9-11-19)6-2-1-3-7-16/h13-14,18H,1-12H2,(H2,17,20)
InChIKeyLPIHTDNBXAIXPE-UHFFFAOYSA-N
XLogP1.64
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 3-(8-azaspiro[4.5]decan-8-yl)-2-(cyclopropylamino)propanoate
CID 63160319
3-(2-azaspiro[4.4]nonan-2-yl)-2-(cyclopropylamino)propanoic acid
CID 114279502
methyl 2-(cyclopropylamino)-3-(4,4-dimethylpiperidin-1-yl)propanoate
CID 55155554
1-(3-azaspiro[5.5]undecan-3-yl)-3-(cyclopropylamino)propan-2-ol
CID 62937041
2-amino-3-(7-azaspiro[3.5]nonan-7-yl)propanamide
CID 130671930
methyl 2-(cyclopropylamino)-3-(1,1-dioxo-1,4-thiazepan-4-yl)propanoate
CID 114083688
2-(cyclopropylamino)-3-(1,1-dioxo-1,4-thiazepan-4-yl)propanoic acid
CID 114083679
(4S)-5-amino-4-(cyclooctylamino)-5-oxopentanoic acid
CID 67336025
methyl 2-(cyclopropylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propanoate
CID 63170968
2-(cyclopropylamino)-4-(3-methoxy-3-methylpiperidin-1-yl)butanamide
CID 107394779
2-(cyclopropylamino)-4-(4-cyclopropylpiperazin-1-yl)butanamide
CID 55144900
2-(cyclopentylamino)-3-methoxypropanamide
CID 115924491

Frequently Asked Questions

What is the IUPAC name of 3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide?
The IUPAC name of 3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide (CID 62931119) is 3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide.
What is the SMILES notation for 3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide?
The canonical SMILES for 3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide is NC(=O)C(CN1CCC2(CCCCC2)CC1)NC1CC1.
What is the InChIKey of 3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide?
The InChIKey is LPIHTDNBXAIXPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c17-15(20)14(18-13-4-5-13)12-19-10-8-16(9-11-19)6-2-1-3-7-16/h13-14,18H,1-12H2,(H2,17,20).
What are the key properties of 3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide?
3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide has a molecular weight of 279.43 g/mol, XLogP of 1.64, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-azaspiro[5.5]undecan-3-yl)-2-(cyclopropylamino)propanamide is sourced from PubChem (CID 62931119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).