3-amino-2-methyl-N-piperidin-1-ylpropanamide

C9H19N3O — CID 83014321

IUPAC3-amino-2-methyl-N-piperidin-1-ylpropanamide
SMILESCC(CN)C(=O)NN1CCCCC1
InChIInChI=1S/C9H19N3O/c1-8(7-10)9(13)11-12-5-3-2-4-6-12/h8H,2-7,10H2,1H3,(H,11,13)
InChIKeyCJSCQWRRBHRNHX-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.10
Rot. Bonds3

About 3-amino-2-methyl-N-piperidin-1-ylpropanamide

3-amino-2-methyl-N-piperidin-1-ylpropanamide (PubChem CID 83014321) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is 3-amino-2-methyl-N-piperidin-1-ylpropanamide.

Molecular Properties

Compound Name3-amino-2-methyl-N-piperidin-1-ylpropanamide
PubChem CID83014321
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name3-amino-2-methyl-N-piperidin-1-ylpropanamide
SMILESCC(CN)C(=O)NN1CCCCC1
InChIInChI=1S/C9H19N3O/c1-8(7-10)9(13)11-12-5-3-2-4-6-12/h8H,2-7,10H2,1H3,(H,11,13)
InChIKeyCJSCQWRRBHRNHX-UHFFFAOYSA-N
XLogP0.10
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-2-methyl-N-piperidin-1-ylpentanamide
CID 104685518
3-methyl-N-piperidin-1-yl-2-sulfanylbutanamide
CID 107033871
2-bromo-3-methyl-N-piperidin-1-ylbutanamide
CID 83012008
(2R)-2-amino-N-piperidin-1-yl-3-sulfanylpropanamide
CID 155192910
2,2-dichloro-N-piperidin-1-ylacetamide
CID 17164475
methyl 3-amino-2-(piperidin-1-ylamino)propanoate
CID 83010908
2-(hydroxymethyl)-3,3-dimethyl-N-piperidin-1-ylbutanamide
CID 58171914
[(2S,3S)-1-(azepan-1-ylamino)-3-methyl-1-oxopentan-2-yl]carbamic acid
CID 154168342
aminomethyl N-piperidin-1-ylcarbamate
CID 154351217
ethyl 2-methyl-3-(piperidin-1-ylamino)propanoate
CID 83014180
4-amino-5-oxo-5-(piperidin-1-ylamino)pentanoic acid
CID 83021302
(2R)-2-amino-3-ethylsulfanyl-N-pyrrolidin-1-ylpropanamide;hydrochloride
CID 70514522

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methyl-N-piperidin-1-ylpropanamide?
The IUPAC name of 3-amino-2-methyl-N-piperidin-1-ylpropanamide (CID 83014321) is 3-amino-2-methyl-N-piperidin-1-ylpropanamide.
What is the SMILES notation for 3-amino-2-methyl-N-piperidin-1-ylpropanamide?
The canonical SMILES for 3-amino-2-methyl-N-piperidin-1-ylpropanamide is CC(CN)C(=O)NN1CCCCC1.
What is the InChIKey of 3-amino-2-methyl-N-piperidin-1-ylpropanamide?
The InChIKey is CJSCQWRRBHRNHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-8(7-10)9(13)11-12-5-3-2-4-6-12/h8H,2-7,10H2,1H3,(H,11,13).
What are the key properties of 3-amino-2-methyl-N-piperidin-1-ylpropanamide?
3-amino-2-methyl-N-piperidin-1-ylpropanamide has a molecular weight of 185.27 g/mol, XLogP of 0.10, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methyl-N-piperidin-1-ylpropanamide is sourced from PubChem (CID 83014321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).