3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine

C16H21N3 — CID 43587097

IUPAC3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine
SMILESCN(CCCc1ccccc1)c1ncccc1CN
InChIInChI=1S/C16H21N3/c1-19(16-15(13-17)10-5-11-18-16)12-6-9-14-7-3-2-4-8-14/h2-5,7-8,10-11H,6,9,12-13,17H2,1H3
InChIKeyBFPVAAIDUXOWKV-UHFFFAOYSA-N
MW255.37 g/mol
LogP2.61
Rot. Bonds6

About 3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine

3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine (PubChem CID 43587097) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is 3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine
PubChem CID43587097
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC Name3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine
SMILESCN(CCCc1ccccc1)c1ncccc1CN
InChIInChI=1S/C16H21N3/c1-19(16-15(13-17)10-5-11-18-16)12-6-9-14-7-3-2-4-8-14/h2-5,7-8,10-11H,6,9,12-13,17H2,1H3
InChIKeyBFPVAAIDUXOWKV-UHFFFAOYSA-N
XLogP2.61
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyrazin-2-amine
CID 62671815
4-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridazin-3-amine
CID 80507508
3-bromo-N-methyl-N-(3-phenylpropyl)pyridin-2-amine
CID 61373185
[2-[methyl(2-phenylethyl)amino]-3-pyridinyl]methanol
CID 65488591
3-bromo-N,4-dimethyl-N-(3-phenylpropyl)pyridin-2-amine
CID 106876609
3-[methyl(3-phenylpropyl)amino]-1H-pyrazin-2-one
CID 115657080
3-(aminomethyl)-N-methyl-N-(2-methylbutyl)pyridin-2-amine
CID 43295307
4-(aminomethyl)-N,3-dimethyl-N-(3-phenylpropyl)aniline
CID 81273880
1-ethyl-3-[methyl(3-phenylpropyl)amino]pyrazin-2-one
CID 133446320
3-N-methyl-3-N-(2-phenylethyl)pyrazine-2,3-diamine
CID 113228940
N-methyl-N-(4-phenylbutyl)pyridin-2-amine
CID 102464733
[2-[methyl(pentyl)amino]-3-pyridinyl]methanol
CID 61256458

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine?
The IUPAC name of 3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine (CID 43587097) is 3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine?
The canonical SMILES for 3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine is CN(CCCc1ccccc1)c1ncccc1CN.
What is the InChIKey of 3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine?
The InChIKey is BFPVAAIDUXOWKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-19(16-15(13-17)10-5-11-18-16)12-6-9-14-7-3-2-4-8-14/h2-5,7-8,10-11H,6,9,12-13,17H2,1H3.
What are the key properties of 3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine?
3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine has a molecular weight of 255.37 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridin-2-amine is sourced from PubChem (CID 43587097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).