N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine

C14H23N3 — CID 81246740

IUPACN-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine
SMILESCCCCN(c1ccncc1CNC)C1CC1
InChIInChI=1S/C14H23N3/c1-3-4-9-17(13-5-6-13)14-7-8-16-11-12(14)10-15-2/h7-8,11,13,15H,3-6,9-10H2,1-2H3
InChIKeyBSIJLAZUKKEODW-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.57
Rot. Bonds7

About N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine

N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine (PubChem CID 81246740) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine.

Molecular Properties

Compound NameN-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine
PubChem CID81246740
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine
SMILESCCCCN(c1ccncc1CNC)C1CC1
InChIInChI=1S/C14H23N3/c1-3-4-9-17(13-5-6-13)14-7-8-16-11-12(14)10-15-2/h7-8,11,13,15H,3-6,9-10H2,1-2H3
InChIKeyBSIJLAZUKKEODW-UHFFFAOYSA-N
XLogP2.57
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-3-(methylaminomethyl)-N-(3-methylbutyl)pyridin-4-amine
CID 81247339
N-cyclopropyl-3-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-4-amine
CID 81247478
N-butyl-N-cyclopropyl-3-methyl-4-(methylaminomethyl)aniline
CID 62136236
N-cycloheptyl-N-methyl-3-(methylaminomethyl)pyridin-4-amine
CID 81247152
N-cyclohexyl-N-methyl-3-(methylaminomethyl)pyridin-4-amine
CID 81249487
N-butyl-N-methyl-4-(methylaminomethyl)pyridin-3-amine
CID 105072693
N-cyclopropyl-N-(cyclopropylmethyl)-4-(methylaminomethyl)pyridin-3-amine
CID 105074049
N-butyl-N-cyclopropyl-5-(methylaminomethyl)pyridin-2-amine
CID 62283747
N-butyl-N-cyclopropyl-6-(methylaminomethyl)pyridazin-3-amine
CID 62283591
N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methylpropyl)pyridin-4-amine
CID 81246811
N,N-dibutyl-3-(propylaminomethyl)pyridin-4-amine
CID 81249392
N-butyl-N-cyclopropyl-6-(methylaminomethyl)pyridin-2-amine
CID 62283573

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine?
The IUPAC name of N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine (CID 81246740) is N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine.
What is the SMILES notation for N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine?
The canonical SMILES for N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine is CCCCN(c1ccncc1CNC)C1CC1.
What is the InChIKey of N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine?
The InChIKey is BSIJLAZUKKEODW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-3-4-9-17(13-5-6-13)14-7-8-16-11-12(14)10-15-2/h7-8,11,13,15H,3-6,9-10H2,1-2H3.
What are the key properties of N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine?
N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine has a molecular weight of 233.36 g/mol, XLogP of 2.57, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-cyclopropyl-3-(methylaminomethyl)pyridin-4-amine is sourced from PubChem (CID 81246740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).