5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine

C14H23N3 — CID 81246878

IUPAC5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine
SMILESCc1cc(N(CC(C)C)C2CC2)c(CN)cn1
InChIInChI=1S/C14H23N3/c1-10(2)9-17(13-4-5-13)14-6-11(3)16-8-12(14)7-15/h6,8,10,13H,4-5,7,9,15H2,1-3H3
InChIKeyVIIJKNKTAQCZLA-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.47
Rot. Bonds5

About 5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine

5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine (PubChem CID 81246878) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine.

Molecular Properties

Compound Name5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine
PubChem CID81246878
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine
SMILESCc1cc(N(CC(C)C)C2CC2)c(CN)cn1
InChIInChI=1S/C14H23N3/c1-10(2)9-17(13-4-5-13)14-6-11(3)16-8-12(14)7-15/h6,8,10,13H,4-5,7,9,15H2,1-3H3
InChIKeyVIIJKNKTAQCZLA-UHFFFAOYSA-N
XLogP2.47
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-methyl-5-(methylaminomethyl)-N-(2-methylpropyl)pyridin-4-amine
CID 81246744
5-(aminomethyl)-N-cyclopropyl-4-methyl-N-(2-methylpropyl)pyrimidin-2-amine
CID 83185973
5-(aminomethyl)-2-methyl-N,N-bis(3-methylbutyl)pyridin-4-amine
CID 107871241
2-(aminomethyl)-5-bromo-N-cyclopropyl-N-(2-methylpropyl)aniline
CID 55001986
5-(aminomethyl)-N,2-dimethyl-N-(1-methylpiperidin-4-yl)pyridin-4-amine
CID 81248708
4-[cyclopentyl(2-methylpropyl)amino]-6-methylpyridine-3-carboxylic acid
CID 81244045
N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine
CID 81254130
5-(aminomethyl)-N,2-dimethyl-N-(2-methylbutyl)pyridin-4-amine
CID 81248991
4-(aminomethyl)-5-chloro-N-cyclopentyl-N-(2-methylpropyl)pyridin-2-amine
CID 114926791
N-cyclopentyl-N-ethyl-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine
CID 81249270
4-(aminomethyl)-N-cyclopentyl-6-methyl-N-(2-methylpropyl)pyrimidin-2-amine
CID 107542143
N-cyclopropyl-N-(2-methoxyethyl)-2-methyl-5-[(propan-2-ylamino)methyl]pyridin-4-amine
CID 81246152

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine?
The IUPAC name of 5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine (CID 81246878) is 5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine.
What is the SMILES notation for 5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine?
The canonical SMILES for 5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine is Cc1cc(N(CC(C)C)C2CC2)c(CN)cn1.
What is the InChIKey of 5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine?
The InChIKey is VIIJKNKTAQCZLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-10(2)9-17(13-4-5-13)14-6-11(3)16-8-12(14)7-15/h6,8,10,13H,4-5,7,9,15H2,1-3H3.
What are the key properties of 5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine?
5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine has a molecular weight of 233.36 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)pyridin-4-amine is sourced from PubChem (CID 81246878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).