N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide

C10H21N3O — CID 96683106

IUPACN-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide
SMILESCC1CCN(C(=O)N[C@H](C)CN)CC1
InChIInChI=1S/C10H21N3O/c1-8-3-5-13(6-4-8)10(14)12-9(2)7-11/h8-9H,3-7,11H2,1-2H3,(H,12,14)/t9-/m1/s1
InChIKeyKXJMPQVREPCKBW-SECBINFHSA-N
MW199.30 g/mol
LogP0.78
Rot. Bonds2

About N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide

N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide (PubChem CID 96683106) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide
PubChem CID96683106
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC NameN-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide
SMILESCC1CCN(C(=O)N[C@H](C)CN)CC1
InChIInChI=1S/C10H21N3O/c1-8-3-5-13(6-4-8)10(14)12-9(2)7-11/h8-9H,3-7,11H2,1-2H3,(H,12,14)/t9-/m1/s1
InChIKeyKXJMPQVREPCKBW-SECBINFHSA-N
XLogP0.78
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2S)-1-hydroxypropan-2-yl]-4-methylpiperidine-1-carboxamide
CID 79159288
N-[(2R)-1-aminopropan-2-yl]azepane-1-carboxamide
CID 96683108
4-methyl-N-(1-piperidin-1-ylpropan-2-yl)piperidine-1-carboxamide
CID 115583839
N-(4-amino-4-iminobutan-2-yl)-4-methylpiperidine-1-carboxamide
CID 79162512
(2S)-2-[(4-methylpiperidine-1-carbonyl)amino]propanoic acid
CID 942904
N-(3-ethylpentan-2-yl)-4-methylpiperidine-1-carboxamide
CID 115619164
methyl 3-methyl-2-[(4-methylpiperidine-1-carbonyl)amino]butanoate
CID 5027485
N-(dicyclopropylmethyl)-4-methylpiperidine-1-carboxamide
CID 113224116
N-(1-cyanoethyl)-4-methylpiperidine-1-carboxamide
CID 79160605
2-(aminomethyl)-3-methyl-1-(4-methylazepan-1-yl)butan-1-one
CID 63622833
(2R)-3-hydroxy-2-[(4-methylpiperidine-1-carbonyl)amino]propanoic acid
CID 80750387
3-hydroxy-2-[(4-methylpiperidine-1-carbonyl)amino]propanoic acid
CID 61188214

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide?
The IUPAC name of N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide (CID 96683106) is N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide?
The canonical SMILES for N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide is CC1CCN(C(=O)N[C@H](C)CN)CC1.
What is the InChIKey of N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide?
The InChIKey is KXJMPQVREPCKBW-SECBINFHSA-N. The full InChI is InChI=1S/C10H21N3O/c1-8-3-5-13(6-4-8)10(14)12-9(2)7-11/h8-9H,3-7,11H2,1-2H3,(H,12,14)/t9-/m1/s1.
What are the key properties of N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide?
N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide has a molecular weight of 199.30 g/mol, XLogP of 0.78, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-aminopropan-2-yl]-4-methylpiperidine-1-carboxamide is sourced from PubChem (CID 96683106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).