2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide

C10H21N3O — CID 103441346

IUPAC2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide
SMILESCC1CCN(C(=O)N(C)C)C(CN)C1
InChIInChI=1S/C10H21N3O/c1-8-4-5-13(9(6-8)7-11)10(14)12(2)3/h8-9H,4-7,11H2,1-3H3
InChIKeyMCXDMTGXKZCDAW-UHFFFAOYSA-N
MW199.30 g/mol
LogP0.73
Rot. Bonds1

About 2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide

2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide (PubChem CID 103441346) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide.

Molecular Properties

Compound Name2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide
PubChem CID103441346
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide
SMILESCC1CCN(C(=O)N(C)C)C(CN)C1
InChIInChI=1S/C10H21N3O/c1-8-4-5-13(9(6-8)7-11)10(14)12(2)3/h8-9H,4-7,11H2,1-3H3
InChIKeyMCXDMTGXKZCDAW-UHFFFAOYSA-N
XLogP0.73
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(aminomethyl)-4-methyl-N-propan-2-ylpiperidine-1-carboxamide
CID 103441340
(2R)-2-amino-1-[2-(aminomethyl)-4-methylpiperidin-1-yl]propan-1-one;hydrochloride
CID 130743724
1-[2-(aminomethyl)-4-methylpiperidin-1-yl]-2-methylsulfonylethanone
CID 103440864
1-[2-(aminomethyl)-4-methylpiperidin-1-yl]-4-methylpentan-1-one
CID 103440808
1-[2-(aminomethyl)-4-methylpiperidin-1-yl]-3,4,4-trimethylpentan-1-one
CID 103441005
[2-(aminomethyl)-4-methylpiperidin-1-yl]-(2,4-dimethyl-1,3-oxazol-5-yl)methanone
CID 103441091
1-[2-(aminomethyl)-4-methylpiperidin-1-yl]-4-ethoxybutan-1-one
CID 103440873
[2-(aminomethyl)-4-methylpiperidin-1-yl]-(1,1-dioxothiolan-3-yl)methanone
CID 103440929
[2-(aminomethyl)-4-methylpiperidin-1-yl]-(1H-1,2,4-triazol-5-yl)methanone
CID 103440862
[2-(aminomethyl)-4-methylpiperidin-1-yl]-(2,4,6-trifluorophenyl)methanone
CID 103441080
2-(aminomethyl)-4-methyl-N-phenylpiperidine-1-carboxamide
CID 103441332
2-[2-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopropyl-N-methylacetamide
CID 63839894

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide?
The IUPAC name of 2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide (CID 103441346) is 2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide.
What is the SMILES notation for 2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide?
The canonical SMILES for 2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide is CC1CCN(C(=O)N(C)C)C(CN)C1.
What is the InChIKey of 2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide?
The InChIKey is MCXDMTGXKZCDAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-8-4-5-13(9(6-8)7-11)10(14)12(2)3/h8-9H,4-7,11H2,1-3H3.
What are the key properties of 2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide?
2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide has a molecular weight of 199.30 g/mol, XLogP of 0.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N,N,4-trimethylpiperidine-1-carboxamide is sourced from PubChem (CID 103441346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).