3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine

C10H17N3 — CID 81249725

IUPAC3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine
SMILESCC(C)N(C)c1ccncc1CN
InChIInChI=1S/C10H17N3/c1-8(2)13(3)10-4-5-12-7-9(10)6-11/h4-5,7-8H,6,11H2,1-3H3
InChIKeyCPNURPBUZPSNGU-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.38
Rot. Bonds3

About 3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine

3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine (PubChem CID 81249725) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine
PubChem CID81249725
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine
SMILESCC(C)N(C)c1ccncc1CN
InChIInChI=1S/C10H17N3/c1-8(2)13(3)10-4-5-12-7-9(10)6-11/h4-5,7-8H,6,11H2,1-3H3
InChIKeyCPNURPBUZPSNGU-UHFFFAOYSA-N
XLogP1.38
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(chloromethyl)-N-methyl-N-propan-2-ylpyridin-4-amine
CID 81237062
3-(aminomethyl)-N-propan-2-yl-N-propylpyridin-4-amine
CID 81248637
3-(aminomethyl)-N-methyl-N-pentylpyridin-4-amine
CID 81248532
3-(aminomethyl)-N-(2,2-dimethylpropyl)-N-methylpyridin-4-amine
CID 81246543
3-(aminomethyl)-N-(2-ethoxyethyl)-N-methylpyridin-4-amine
CID 81248237
3-(aminomethyl)-N,N-bis(2-ethoxyethyl)pyridin-4-amine
CID 82952880
N-methyl-4-(methylaminomethyl)-N-propan-2-ylpyridin-3-amine
CID 105072723
N-butan-2-yl-3-(chloromethyl)-N-methylpyridin-4-amine
CID 81238160
3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine
CID 81246480
4-(aminomethyl)-N-(2-methoxyethyl)-N-propan-2-ylpyridin-3-amine
CID 82948054
4-N-(1-aminopropan-2-yl)-4-N-methylpyridine-3,4-diamine
CID 82503805
[3-(aminomethyl)-4-pyridinyl]methanamine;dihydrochloride
CID 66524168

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine?
The IUPAC name of 3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine (CID 81249725) is 3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine.
What is the SMILES notation for 3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine?
The canonical SMILES for 3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine is CC(C)N(C)c1ccncc1CN.
What is the InChIKey of 3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine?
The InChIKey is CPNURPBUZPSNGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-8(2)13(3)10-4-5-12-7-9(10)6-11/h4-5,7-8H,6,11H2,1-3H3.
What are the key properties of 3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine?
3-(aminomethyl)-N-methyl-N-propan-2-ylpyridin-4-amine has a molecular weight of 179.27 g/mol, XLogP of 1.38, 3 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-propan-2-ylpyridin-4-amine is sourced from PubChem (CID 81249725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).