6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide

C15H24N4O — CID 106620244

IUPAC6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide
SMILESCCCCN(CC1CCCN1)c1ccc(C(N)=O)cn1
InChIInChI=1S/C15H24N4O/c1-2-3-9-19(11-13-5-4-8-17-13)14-7-6-12(10-18-14)15(16)20/h6-7,10,13,17H,2-5,8-9,11H2,1H3,(H2,16,20)
InChIKeyBSMRODSXFPTEMO-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.54
Rot. Bonds7

About 6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide

6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide (PubChem CID 106620244) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide
PubChem CID106620244
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide
SMILESCCCCN(CC1CCCN1)c1ccc(C(N)=O)cn1
InChIInChI=1S/C15H24N4O/c1-2-3-9-19(11-13-5-4-8-17-13)14-7-6-12(10-18-14)15(16)20/h6-7,10,13,17H,2-5,8-9,11H2,1H3,(H2,16,20)
InChIKeyBSMRODSXFPTEMO-UHFFFAOYSA-N
XLogP1.54
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridazine-3-carboxamide
CID 106620429
6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-2-carboxamide
CID 106620470
6-[butyl(pyrrolidin-2-ylmethyl)amino]-N-methylpyridazine-3-carboxamide
CID 106620446
2-[piperidin-2-ylmethyl(propyl)amino]pyridine-4-carboxamide
CID 106642290
2-[(5-methyl-2-pyridinyl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106621156
6-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]pyridazine-3-carboxamide
CID 106621384
N-butyl-6-ethoxy-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 106620441
N-butyl-N-(pyrrolidin-2-ylmethyl)aniline
CID 64585394
4-[ethyl(pyrrolidin-2-ylmethyl)amino]-3-fluorobenzamide
CID 106619510
6-[ethyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carbonitrile
CID 106619350
N-butyl-4,6-dimethoxy-N-(pyrrolidin-2-ylmethyl)-1,3,5-triazin-2-amine
CID 106620394
N-butyl-3-chloro-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 106620455

Frequently Asked Questions

What is the IUPAC name of 6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide?
The IUPAC name of 6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide (CID 106620244) is 6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide.
What is the SMILES notation for 6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide?
The canonical SMILES for 6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide is CCCCN(CC1CCCN1)c1ccc(C(N)=O)cn1.
What is the InChIKey of 6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide?
The InChIKey is BSMRODSXFPTEMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-2-3-9-19(11-13-5-4-8-17-13)14-7-6-12(10-18-14)15(16)20/h6-7,10,13,17H,2-5,8-9,11H2,1H3,(H2,16,20).
What are the key properties of 6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide?
6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.54, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 106620244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).