N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide

C17H25N3O3 — CID 91788122

IUPACN-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)NC(C2CCNCC2)C2CC(O)C2)cn1
InChIInChI=1S/C17H25N3O3/c1-23-15-3-2-12(10-19-15)17(22)20-16(13-8-14(21)9-13)11-4-6-18-7-5-11/h2-3,10-11,13-14,16,18,21H,4-9H2,1H3,(H,20,22)
InChIKeyGHWAVQROBADXPR-UHFFFAOYSA-N
MW319.40 g/mol
LogP0.96
Rot. Bonds5

About N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide

N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide (PubChem CID 91788122) has the molecular formula C17H25N3O3 and a molecular weight of 319.40 g/mol. Its IUPAC name is N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide
PubChem CID91788122
Molecular FormulaC17H25N3O3
Molecular Weight319.40 g/mol
Exact Mass319.19
IUPAC NameN-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)NC(C2CCNCC2)C2CC(O)C2)cn1
InChIInChI=1S/C17H25N3O3/c1-23-15-3-2-12(10-19-15)17(22)20-16(13-8-14(21)9-13)11-4-6-18-7-5-11/h2-3,10-11,13-14,16,18,21H,4-9H2,1H3,(H,20,22)
InChIKeyGHWAVQROBADXPR-UHFFFAOYSA-N
XLogP0.96
TPSA83.48 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 50.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-amino-N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]pyridine-3-carboxamide;dihydrochloride
CID 154903478
N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-6-methylpyridine-3-carboxamide
CID 91784748
6-bromo-N-(dicyclopropylmethyl)pyridine-3-carboxamide
CID 66462749
N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 91787162
(2S)-2-[(6-methoxypyridine-3-carbonyl)amino]-2-phenylacetic acid
CID 93310081
N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide
CID 113232040
5-chloro-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-6-oxo-1H-pyridine-3-carboxamide
CID 91781221
N-[1-(4-fluorophenyl)ethyl]-6-methoxypyridine-3-carboxamide
CID 134016008
2-[(6-methoxypyridine-3-carbonyl)amino]-2-(oxan-3-yl)acetic acid
CID 120547837
3-hydroxy-2-[(6-methoxypyridine-3-carbonyl)amino]butanoic acid
CID 43353726
1-ethyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]pyrazole-4-carboxamide
CID 91765736
N-[4-(cyclopropylcarbamoyl)phenyl]-6-methoxypyridine-3-carboxamide
CID 51300111

Frequently Asked Questions

What is the IUPAC name of N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide?
The IUPAC name of N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide (CID 91788122) is N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide?
The canonical SMILES for N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide is COc1ccc(C(=O)NC(C2CCNCC2)C2CC(O)C2)cn1.
What is the InChIKey of N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide?
The InChIKey is GHWAVQROBADXPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-23-15-3-2-12(10-19-15)17(22)20-16(13-8-14(21)9-13)11-4-6-18-7-5-11/h2-3,10-11,13-14,16,18,21H,4-9H2,1H3,(H,20,22).
What are the key properties of N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide?
N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide has a molecular weight of 319.40 g/mol, XLogP of 0.96, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-hydroxycyclobutyl)-piperidin-4-ylmethyl]-6-methoxypyridine-3-carboxamide is sourced from PubChem (CID 91788122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).