4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide

C14H22N4O — CID 81243360

IUPAC4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide
SMILESCNc1ccncc1C(=O)NCC1CCCN(C)C1
InChIInChI=1S/C14H22N4O/c1-15-13-5-6-16-9-12(13)14(19)17-8-11-4-3-7-18(2)10-11/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H,15,16)(H,17,19)
InChIKeyYVHKNNJUDDZREW-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.19
Rot. Bonds4

About 4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide

4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide (PubChem CID 81243360) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide
PubChem CID81243360
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide
SMILESCNc1ccncc1C(=O)NCC1CCCN(C)C1
InChIInChI=1S/C14H22N4O/c1-15-13-5-6-16-9-12(13)14(19)17-8-11-4-3-7-18(2)10-11/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H,15,16)(H,17,19)
InChIKeyYVHKNNJUDDZREW-UHFFFAOYSA-N
XLogP1.19
TPSA57.26 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 ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1,1-dioxothiolan-3-yl)methyl]-4-(methylamino)pyridine-3-carboxamide
CID 81242593
N-(cyclopentylmethyl)-4-hydrazinylpyridine-3-carboxamide
CID 81256785
3-(methylamino)-N-[(1-methylpyrrolidin-2-yl)methyl]pyridine-4-carboxamide
CID 114138605
N-(cyclopentylmethyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81236600
N-[(1-methylpiperidin-3-yl)methyl]-2-(propan-2-ylamino)benzamide
CID 63108415
3-chloro-N-[(1-methylpiperidin-3-yl)methyl]pyridin-4-amine
CID 79840711
4-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridine-3-carboxamide
CID 103872767
3-(3-hydroxyprop-1-ynyl)-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-carboxamide
CID 66482261
2-bromo-3-methyl-N-[(1-methylpiperidin-3-yl)methyl]benzamide
CID 113339088
2-(2-methylphenyl)-N-[[(3R)-1-methylpiperidin-3-yl]methyl]benzamide
CID 95207411
2,4,5-trimethoxy-N-[[(3S)-1-methylpiperidin-3-yl]methyl]benzamide
CID 95213688
2-bromo-4-chloro-N-[(1-methylpiperidin-3-yl)methyl]benzamide
CID 103765330

Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of 4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide (CID 81243360) is 4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide is CNc1ccncc1C(=O)NCC1CCCN(C)C1.
What is the InChIKey of 4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide?
The InChIKey is YVHKNNJUDDZREW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-15-13-5-6-16-9-12(13)14(19)17-8-11-4-3-7-18(2)10-11/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H,15,16)(H,17,19).
What are the key properties of 4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide?
4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide has a molecular weight of 262.36 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 81243360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).