2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide

C19H30N4O — CID 70707861

IUPAC2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide
SMILESCNC(=O)c1ccnc(NC2CCCN(CC3CCCCC3)C2)c1
InChIInChI=1S/C19H30N4O/c1-20-19(24)16-9-10-21-18(12-16)22-17-8-5-11-23(14-17)13-15-6-3-2-4-7-15/h9-10,12,15,17H,2-8,11,13-14H2,1H3,(H,20,24)(H,21,22)
InChIKeyQWQNBCUQJGUSBF-UHFFFAOYSA-N
MW330.48 g/mol
LogP2.90
Rot. Bonds5

About 2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide

2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide (PubChem CID 70707861) has the molecular formula C19H30N4O and a molecular weight of 330.48 g/mol. Its IUPAC name is 2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide
PubChem CID70707861
Molecular FormulaC19H30N4O
Molecular Weight330.48 g/mol
Exact Mass330.24
IUPAC Name2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide
SMILESCNC(=O)c1ccnc(NC2CCCN(CC3CCCCC3)C2)c1
InChIInChI=1S/C19H30N4O/c1-20-19(24)16-9-10-21-18(12-16)22-17-8-5-11-23(14-17)13-15-6-3-2-4-7-15/h9-10,12,15,17H,2-8,11,13-14H2,1H3,(H,20,24)(H,21,22)
InChIKeyQWQNBCUQJGUSBF-UHFFFAOYSA-N
XLogP2.90
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.48
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclopropylamino)-N-methylpyridine-4-carboxamide
CID 130666257
6-[[(3S)-1-(cyclohexylmethyl)piperidin-3-yl]amino]-N,N-dimethylpyridine-3-carboxamide
CID 95894858
6-[[(3R)-1-(cyclohexylmethyl)piperidin-3-yl]amino]-N,N-dimethylpyridine-3-carboxamide
CID 95894857
N-(1-ethylpiperidin-3-yl)-2-(methylamino)pyridine-4-carboxamide
CID 62175971
N-[(3S)-1-(cyclohexylmethyl)piperidin-3-yl]-3-methylbenzamide
CID 25448585
6-N-[1-(cyclohexylmethyl)piperidin-3-yl]-4-N,4-N-dimethylpyrimidine-4,6-diamine
CID 171998123
N-[(3R)-1-(cyclohexylmethyl)piperidin-3-yl]-3-(pyrazol-1-ylmethyl)benzamide
CID 42592717
3-[6-[[(3R)-1-(cyclohexylmethyl)piperidin-3-yl]amino]-3-pyridinyl]-N-hydroxyprop-2-enamide
CID 91180936
N-[1-(cyclohexylmethyl)piperidin-3-yl]-1-methylpyrazole-4-carboxamide
CID 171993172
acetic acid;(E)-3-[6-[[(3R)-1-(cyclohexylmethyl)piperidin-3-yl]amino]-3-pyridinyl]-N-hydroxyprop-2-enamide
CID 87636807
N-[1-(cyclohexylmethyl)piperidin-3-yl]-2-methylfuran-3-carboxamide
CID 45178957
(Z)-3-[6-[[(3R)-1-(cyclohexylmethyl)piperidin-3-yl]amino]-3-pyridinyl]-2-fluoro-N-hydroxyprop-2-enamide
CID 87638448

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide?
The IUPAC name of 2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide (CID 70707861) is 2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide.
What is the SMILES notation for 2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide?
The canonical SMILES for 2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide is CNC(=O)c1ccnc(NC2CCCN(CC3CCCCC3)C2)c1.
What is the InChIKey of 2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide?
The InChIKey is QWQNBCUQJGUSBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O/c1-20-19(24)16-9-10-21-18(12-16)22-17-8-5-11-23(14-17)13-15-6-3-2-4-7-15/h9-10,12,15,17H,2-8,11,13-14H2,1H3,(H,20,24)(H,21,22).
What are the key properties of 2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide?
2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide has a molecular weight of 330.48 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(cyclohexylmethyl)piperidin-3-yl]amino]-N-methylpyridine-4-carboxamide is sourced from PubChem (CID 70707861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).