3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine

C12H19N3 — CID 81247312

IUPAC3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine
SMILESCCN(CC1CC1)c1ccncc1CN
InChIInChI=1S/C12H19N3/c1-2-15(9-10-3-4-10)12-5-6-14-8-11(12)7-13/h5-6,8,10H,2-4,7,9,13H2,1H3
InChIKeyCXPIOMYWOBMJAP-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.78
Rot. Bonds5

About 3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine

3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine (PubChem CID 81247312) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine
PubChem CID81247312
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine
SMILESCCN(CC1CC1)c1ccncc1CN
InChIInChI=1S/C12H19N3/c1-2-15(9-10-3-4-10)12-5-6-14-8-11(12)7-13/h5-6,8,10H,2-4,7,9,13H2,1H3
InChIKeyCXPIOMYWOBMJAP-UHFFFAOYSA-N
XLogP1.78
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(cyclobutylmethyl)-4-N-ethylpyridine-3,4-diamine
CID 107397217
N-(cyclopropylmethyl)-N-ethyl-4-(methylaminomethyl)pyridin-3-amine
CID 105073981
3-(aminomethyl)-N-benzyl-N-ethylpyridin-4-amine
CID 81248963
3-[cyclopropylmethyl(ethyl)amino]pyridine-4-carbothioamide
CID 114288566
4-[(tert-butylamino)methyl]-N-(cyclopropylmethyl)-N-ethylpyridin-3-amine
CID 105073982
4-[cyclobutylmethyl(ethyl)amino]pyridine-3-carboxylic acid
CID 107399152
3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine
CID 82952880
4-(aminomethyl)-3-chloro-N-(cyclopropylmethyl)-N-ethylpyridin-2-amine
CID 107055569
3-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine
CID 81248637
3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine
CID 81249725
3-(aminomethyl)-N-ethyl-N-(2-methylphenyl)pyridin-4-amine
CID 81249174
4-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-2-propan-2-ylpyrimidin-5-amine
CID 63938723

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine?
The IUPAC name of 3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine (CID 81247312) is 3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine.
What is the SMILES notation for 3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine?
The canonical SMILES for 3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine is CCN(CC1CC1)c1ccncc1CN.
What is the InChIKey of 3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine?
The InChIKey is CXPIOMYWOBMJAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-2-15(9-10-3-4-10)12-5-6-14-8-11(12)7-13/h5-6,8,10H,2-4,7,9,13H2,1H3.
What are the key properties of 3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine?
3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine has a molecular weight of 205.31 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-(cyclopropylmethyl)-N-ethylpyridin-4-amine is sourced from PubChem (CID 81247312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).