2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine

C13H19N3 — CID 104740127

IUPAC2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine
SMILESNc1cccnc1CN(CC1CC1)C1CC1
InChIInChI=1S/C13H19N3/c14-12-2-1-7-15-13(12)9-16(11-5-6-11)8-10-3-4-10/h1-2,7,10-11H,3-6,8-9,14H2
InChIKeySDXGFWKWXLYYBD-UHFFFAOYSA-N
MW217.32 g/mol
LogP2.04
Rot. Bonds5

About 2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine

2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine (PubChem CID 104740127) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine.

Molecular Properties

Compound Name2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine
PubChem CID104740127
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine
SMILESNc1cccnc1CN(CC1CC1)C1CC1
InChIInChI=1S/C13H19N3/c14-12-2-1-7-15-13(12)9-16(11-5-6-11)8-10-3-4-10/h1-2,7,10-11H,3-6,8-9,14H2
InChIKeySDXGFWKWXLYYBD-UHFFFAOYSA-N
XLogP2.04
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-Diaminopyridine
CID 5918
Betahistine
CID 2366
2-Pyridineethanamine
CID 75919
3-Aminopyridine
CID 10009
2-Pyridinemethanamine
CID 19509
1-Pyridin-3-yl-1,4-diazepane
CID 10654891
N,N-dimethylpyridine-2-ethylamine
CID 80554
N-methyl-1-(pyridin-2-yl)methanamine
CID 88757
N-Phenyl-2-pyridinemethanamine
CID 78027
Piperazine, 2-pyridylethyl-
CID 566605
1-(Pyridin-3-yl)piperazine
CID 437234
1-N,1-N-dimethyl-4-N-(pyridin-2-ylmethyl)benzene-1,4-diamine
CID 39247144

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine?
The IUPAC name of 2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine (CID 104740127) is 2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine.
What is the SMILES notation for 2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine?
The canonical SMILES for 2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine is Nc1cccnc1CN(CC1CC1)C1CC1.
What is the InChIKey of 2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine?
The InChIKey is SDXGFWKWXLYYBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c14-12-2-1-7-15-13(12)9-16(11-5-6-11)8-10-3-4-10/h1-2,7,10-11H,3-6,8-9,14H2.
What are the key properties of 2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine?
2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine has a molecular weight of 217.32 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclopropyl(cyclopropylmethyl)amino]methyl]pyridin-3-amine is sourced from PubChem (CID 104740127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).