2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride

C9H19ClN2O — CID 53256452

IUPAC2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride
SMILESCC(C)C(=O)N[C@@H]1CCCNC1.Cl
InChIInChI=1S/C9H18N2O.ClH/c1-7(2)9(12)11-8-4-3-5-10-6-8;/h7-8,10H,3-6H2,1-2H3,(H,11,12);1H/t8-;/m1./s1
InChIKeyRJOLJKMVPUGMOJ-DDWIOCJRSA-N
MW206.72 g/mol
LogP0.93
Rot. Bonds2

About 2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride

2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride (PubChem CID 53256452) has the molecular formula C9H19ClN2O and a molecular weight of 206.72 g/mol. Its IUPAC name is 2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride.

Molecular Properties

Compound Name2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride
PubChem CID53256452
Molecular FormulaC9H19ClN2O
Molecular Weight206.72 g/mol
Exact Mass206.12
IUPAC Name2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride
SMILESCC(C)C(=O)N[C@@H]1CCCNC1.Cl
InChIInChI=1S/C9H18N2O.ClH/c1-7(2)9(12)11-8-4-3-5-10-6-8;/h7-8,10H,3-6H2,1-2H3,(H,11,12);1H/t8-;/m1./s1
InChIKeyRJOLJKMVPUGMOJ-DDWIOCJRSA-N
XLogP0.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.72
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxy-N-[(3S)-piperidin-3-yl]propanamide
CID 103866505
3,3,3-trifluoro-2-methyl-N-piperidin-3-ylpropanamide
CID 119424701
2-[methyl(propan-2-yl)amino]-N-piperidin-3-ylacetamide;dihydrochloride
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(2R)-2-amino-N-piperidin-3-ylbutanamide
CID 131134417
2,2-dimethyl-N-[1-oxo-1-(piperidin-3-ylamino)propan-2-yl]propanamide
CID 119428227
N-piperidin-3-yl-2-pyrazol-1-ylpropanamide;dihydrochloride
CID 119424500
1-cyclopropyl-3-piperidin-3-ylurea
CID 62699673
N-piperidin-3-ylpropanamide
CID 3520588
1-butan-2-yl-3-piperidin-3-ylurea
CID 126971340
N-piperidin-3-yl-N'-propan-2-ylpentanediamide
CID 119425960
3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]-N-[(3S)-piperidin-3-yl]butanamide
CID 167012122
2-but-3-enoxy-N-piperidin-3-ylpropanamide
CID 119429167

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride?
The IUPAC name of 2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride (CID 53256452) is 2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride.
What is the SMILES notation for 2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride?
The canonical SMILES for 2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride is CC(C)C(=O)N[C@@H]1CCCNC1.Cl.
What is the InChIKey of 2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride?
The InChIKey is RJOLJKMVPUGMOJ-DDWIOCJRSA-N. The full InChI is InChI=1S/C9H18N2O.ClH/c1-7(2)9(12)11-8-4-3-5-10-6-8;/h7-8,10H,3-6H2,1-2H3,(H,11,12);1H/t8-;/m1./s1.
What are the key properties of 2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride?
2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride has a molecular weight of 206.72 g/mol, XLogP of 0.93, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(3R)-piperidin-3-yl]propanamide;hydrochloride is sourced from PubChem (CID 53256452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).