N-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine

C10H15N3 — CID 62069804

IUPACN-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine
SMILESNCC(NC1CC1)c1cccnc1
InChIInChI=1S/C10H15N3/c11-6-10(13-9-3-4-9)8-2-1-5-12-7-8/h1-2,5,7,9-10,13H,3-4,6,11H2
InChIKeyIRBNYIPTPYLKMG-UHFFFAOYSA-N
MW177.25 g/mol
LogP0.83
Rot. Bonds4

About N-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine

N-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine (PubChem CID 62069804) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is N-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine
PubChem CID62069804
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC NameN-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine
SMILESNCC(NC1CC1)c1cccnc1
InChIInChI=1S/C10H15N3/c11-6-10(13-9-3-4-9)8-2-1-5-12-7-8/h1-2,5,7,9-10,13H,3-4,6,11H2
InChIKeyIRBNYIPTPYLKMG-UHFFFAOYSA-N
XLogP0.83
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine
CID 26385082
N-(2-methylpropyl)-1-pyridin-3-ylethane-1,2-diamine
CID 65383709
N-cyclopropyl-1-(4-phenylphenyl)ethane-1,2-diamine
CID 55030697
(2-cyclopentyl-1-pyridin-3-ylethyl)hydrazine
CID 105196086
(2R)-2-(cyclopropylamino)-2-pyridin-3-ylacetic acid
CID 93280695
3-N-[(1S)-1-pyridin-3-ylethyl]cyclopentane-1,3-diamine
CID 81406551
methyl 2-(cyclopropylamino)-2-pyridin-3-ylacetate
CID 60795276
2-(2-amino-1-pyridin-3-ylethyl)sulfanyl-N-cyclopropylacetamide
CID 114233493
N-(3-methylphenyl)-1-pyridin-3-ylethane-1,2-diamine
CID 65378191
N-(3-bromophenyl)-1-pyridin-3-ylethane-1,2-diamine
CID 65378943
4-propyl-N-[(1S)-1-pyridin-3-ylethyl]cyclohexan-1-amine
CID 28655963
3-amino-N-cyclopropyl-3-pyridin-3-ylpropanamide
CID 82077122

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine?
The IUPAC name of N-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine (CID 62069804) is N-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine.
What is the SMILES notation for N-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine?
The canonical SMILES for N-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine is NCC(NC1CC1)c1cccnc1.
What is the InChIKey of N-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine?
The InChIKey is IRBNYIPTPYLKMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c11-6-10(13-9-3-4-9)8-2-1-5-12-7-8/h1-2,5,7,9-10,13H,3-4,6,11H2.
What are the key properties of N-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine?
N-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine has a molecular weight of 177.25 g/mol, XLogP of 0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-pyridin-3-ylethane-1,2-diamine is sourced from PubChem (CID 62069804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).