5-[(cyclopentylamino)methyl]pyridine-2-carboxamide

C12H17N3O — CID 115685055

IUPAC5-[(cyclopentylamino)methyl]pyridine-2-carboxamide
SMILESNC(=O)c1ccc(CNC2CCCC2)cn1
InChIInChI=1S/C12H17N3O/c13-12(16)11-6-5-9(8-15-11)7-14-10-3-1-2-4-10/h5-6,8,10,14H,1-4,7H2,(H2,13,16)
InChIKeyMYXWOPQEMMCVRL-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.21
Rot. Bonds4

About 5-[(cyclopentylamino)methyl]pyridine-2-carboxamide

5-[(cyclopentylamino)methyl]pyridine-2-carboxamide (PubChem CID 115685055) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is 5-[(cyclopentylamino)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[(cyclopentylamino)methyl]pyridine-2-carboxamide
PubChem CID115685055
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name5-[(cyclopentylamino)methyl]pyridine-2-carboxamide
SMILESNC(=O)c1ccc(CNC2CCCC2)cn1
InChIInChI=1S/C12H17N3O/c13-12(16)11-6-5-9(8-15-11)7-14-10-3-1-2-4-10/h5-6,8,10,14H,1-4,7H2,(H2,13,16)
InChIKeyMYXWOPQEMMCVRL-UHFFFAOYSA-N
XLogP1.21
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(propan-2-ylamino)methyl]pyridine-2-carboxamide
CID 115906161
molecular hydrogen;5-[[[(2R)-oxolan-2-yl]methylamino]methyl]pyridine-2-carboxamide
CID 171489904
2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide
CID 80632703
5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide
CID 150999370
2-[(2-amino-2-oxoethyl)-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide
CID 80635727
N-[(6-chloro-3-pyridinyl)methyl]cyclohexanamine
CID 59828914
5-[(cyclohexylamino)methyl]furan-2-carboxamide
CID 115672619
N-[(6-bromo-3-pyridinyl)methyl]cyclobutanamine
CID 146014724
2-[4-[(cyclohexylamino)methyl]phenoxy]acetamide
CID 2991496
4-[(cyclopentylamino)methyl]phenol
CID 3873791
N-[(6-methyl-3-pyridinyl)methyl]cyclopropanamine
CID 43163855
N-(pyridazin-4-ylmethyl)cyclohexanamine
CID 104670108

Frequently Asked Questions

What is the IUPAC name of 5-[(cyclopentylamino)methyl]pyridine-2-carboxamide?
The IUPAC name of 5-[(cyclopentylamino)methyl]pyridine-2-carboxamide (CID 115685055) is 5-[(cyclopentylamino)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-[(cyclopentylamino)methyl]pyridine-2-carboxamide?
The canonical SMILES for 5-[(cyclopentylamino)methyl]pyridine-2-carboxamide is NC(=O)c1ccc(CNC2CCCC2)cn1.
What is the InChIKey of 5-[(cyclopentylamino)methyl]pyridine-2-carboxamide?
The InChIKey is MYXWOPQEMMCVRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c13-12(16)11-6-5-9(8-15-11)7-14-10-3-1-2-4-10/h5-6,8,10,14H,1-4,7H2,(H2,13,16).
What are the key properties of 5-[(cyclopentylamino)methyl]pyridine-2-carboxamide?
5-[(cyclopentylamino)methyl]pyridine-2-carboxamide has a molecular weight of 219.29 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(cyclopentylamino)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 115685055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).