1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide

C14H22N4O — CID 62894836

IUPAC1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1Cc1cccnc1CN
InChIInChI=1S/C14H22N4O/c1-10-4-5-12(14(16)19)9-18(10)8-11-3-2-6-17-13(11)7-15/h2-3,6,10,12H,4-5,7-9,15H2,1H3,(H2,16,19)
InChIKeyBTYSFXKKURKYMO-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.63
Rot. Bonds4

About 1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide

1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide (PubChem CID 62894836) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide
PubChem CID62894836
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1Cc1cccnc1CN
InChIInChI=1S/C14H22N4O/c1-10-4-5-12(14(16)19)9-18(10)8-11-3-2-6-17-13(11)7-15/h2-3,6,10,12H,4-5,7-9,15H2,1H3,(H2,16,19)
InChIKeyBTYSFXKKURKYMO-UHFFFAOYSA-N
XLogP0.63
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3S,6S)-1-[(6-chloro-2-methyl-3-pyridinyl)methyl]-6-methylpiperidine-3-carboxamide
CID 97246020
(3R,6R)-1-[(6-chloro-2-methyl-3-pyridinyl)methyl]-6-methylpiperidine-3-carboxamide
CID 98853607
(3R,6S)-6-methyl-1-[(2-methyl-3-nitrophenyl)methyl]piperidine-3-carboxamide
CID 95302032
1-[[4-(ethylamino)-2-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide
CID 79245243
[3-[(2,3-dimethylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
CID 62895699
3-[(5-carbamoyl-2-methylpiperidin-1-yl)methyl]furan-2-carboxylic acid
CID 54989275
(3R,6S)-1-[(5-benzyl-1,3,4-oxadiazol-2-yl)methyl]-6-methylpiperidine-3-carboxamide
CID 95621691
(3S,6S)-1-[(5-benzyl-1,3,4-oxadiazol-2-yl)methyl]-6-methylpiperidine-3-carboxamide
CID 95621689
6-methyl-1-[[5-(methylamino)pyrazin-2-yl]methyl]piperidine-3-carboxamide
CID 103055846
1-[[3-(aminomethyl)-4-methoxyphenyl]methyl]-6-methylpiperidine-3-carboxamide
CID 65338326
(3S,6S)-6-methyl-1-(2-quinolin-8-ylacetyl)piperidine-3-carboxamide
CID 95585501
1-[(3-bromophenyl)methyl]-6-methylpiperidine-3-carboxamide
CID 54989482

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide?
The IUPAC name of 1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide (CID 62894836) is 1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide is CC1CCC(C(N)=O)CN1Cc1cccnc1CN.
What is the InChIKey of 1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide?
The InChIKey is BTYSFXKKURKYMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-10-4-5-12(14(16)19)9-18(10)8-11-3-2-6-17-13(11)7-15/h2-3,6,10,12H,4-5,7-9,15H2,1H3,(H2,16,19).
What are the key properties of 1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide?
1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide has a molecular weight of 262.36 g/mol, XLogP of 0.63, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(aminomethyl)-3-pyridinyl]methyl]-6-methylpiperidine-3-carboxamide is sourced from PubChem (CID 62894836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).