N-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide

C22H27N3O2 — CID 56876819

IUPACN-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide
SMILESO=C(NC1CC1)c1ccnc(-c2cc(O)cc(CCC3CCCCN3)c2)c1
InChIInChI=1S/C22H27N3O2/c26-20-12-15(4-5-18-3-1-2-9-23-18)11-17(13-20)21-14-16(8-10-24-21)22(27)25-19-6-7-19/h8,10-14,18-19,23,26H,1-7,9H2,(H,25,27)
InChIKeyNSUIQULGKFCYMV-UHFFFAOYSA-N
MW365.48 g/mol
LogP3.42
Rot. Bonds6

About N-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide

N-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide (PubChem CID 56876819) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is N-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide
PubChem CID56876819
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC NameN-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide
SMILESO=C(NC1CC1)c1ccnc(-c2cc(O)cc(CCC3CCCCN3)c2)c1
InChIInChI=1S/C22H27N3O2/c26-20-12-15(4-5-18-3-1-2-9-23-18)11-17(13-20)21-14-16(8-10-24-21)22(27)25-19-6-7-19/h8,10-14,18-19,23,26H,1-7,9H2,(H,25,27)
InChIKeyNSUIQULGKFCYMV-UHFFFAOYSA-N
XLogP3.42
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 53.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-[4-(hydroxymethyl)-2-pyridinyl]-5-[2-[(2S)-piperidin-2-yl]ethyl]phenol
CID 95552841
[6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 95399160
6-[3-hydroxy-5-[2-[(2S)-piperidin-2-yl]ethyl]phenyl]-N-propylpyridine-3-carboxamide
CID 95553212
3-(2-piperidin-2-ylethyl)-5-pyrimidin-2-ylphenol
CID 56750474
3-(2-methyl-4-pyridinyl)-5-[2-[(2R)-piperidin-2-yl]ethyl]phenol
CID 95554178
3-[6-(dimethylamino)pyrimidin-4-yl]-5-[2-[(2S)-piperidin-2-yl]ethyl]phenol
CID 95558826
3-[6-(dimethylamino)pyridazin-3-yl]-5-(2-piperidin-2-ylethyl)phenol
CID 56878303
3-[6-[ethyl(methyl)amino]pyrimidin-4-yl]-5-(2-piperidin-2-ylethyl)phenol
CID 56880401
3-(2-piperidin-2-ylethyl)-5-(1-propan-2-ylimidazol-2-yl)phenol
CID 56916448
2-[3-[4-(cyclopropylcarbamoyl)-2-pyridinyl]phenyl]acetic acid
CID 155910539
N-cyclopropyl-2-[3-(hydroxymethyl)phenyl]pyridine-4-carboxamide
CID 121497473
3-(5-ethylsulfonylthiophen-2-yl)-5-(2-piperidin-2-ylethyl)phenol
CID 56868049

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide?
The IUPAC name of N-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide (CID 56876819) is N-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide?
The canonical SMILES for N-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide is O=C(NC1CC1)c1ccnc(-c2cc(O)cc(CCC3CCCCN3)c2)c1.
What is the InChIKey of N-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide?
The InChIKey is NSUIQULGKFCYMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O2/c26-20-12-15(4-5-18-3-1-2-9-23-18)11-17(13-20)21-14-16(8-10-24-21)22(27)25-19-6-7-19/h8,10-14,18-19,23,26H,1-7,9H2,(H,25,27).
What are the key properties of N-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide?
N-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide has a molecular weight of 365.48 g/mol, XLogP of 3.42, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[3-hydroxy-5-(2-piperidin-2-ylethyl)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 56876819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).