[1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride

C10H16Cl2N2 — CID 86277054

IUPAC[1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride
SMILESCl.Cl.NCC1(Cc2cccnc2)CC1
InChIInChI=1S/C10H14N2.2ClH/c11-8-10(3-4-10)6-9-2-1-5-12-7-9;;/h1-2,5,7H,3-4,6,8,11H2;2*1H
InChIKeyUNMUFXYRPXMUKV-UHFFFAOYSA-N
MW235.16 g/mol
LogP2.21
Rot. Bonds3

About [1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride

[1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride (PubChem CID 86277054) has the molecular formula C10H16Cl2N2 and a molecular weight of 235.16 g/mol. Its IUPAC name is [1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride.

Molecular Properties

Compound Name[1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride
PubChem CID86277054
Molecular FormulaC10H16Cl2N2
Molecular Weight235.16 g/mol
Exact Mass234.07
IUPAC Name[1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride
SMILESCl.Cl.NCC1(Cc2cccnc2)CC1
InChIInChI=1S/C10H14N2.2ClH/c11-8-10(3-4-10)6-9-2-1-5-12-7-9;;/h1-2,5,7H,3-4,6,8,11H2;2*1H
InChIKeyUNMUFXYRPXMUKV-UHFFFAOYSA-N
XLogP2.21
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.16
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4,4-difluoro-1-(pyridin-4-ylmethyl)cyclohexyl]methanamine;dihydrochloride
CID 91658683
4-(pyridin-3-ylmethyl)piperidin-4-amine
CID 86277721
1-(pyridin-3-ylmethyl)cyclohexane-1,4-diamine
CID 162146330
1-(pyridin-3-ylmethyl)cyclopropane-1-carbaldehyde
CID 131187567
2,2-dimethyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine
CID 104735918
N-[(1-ethylcyclopropyl)methyl]-1-pyridin-3-ylmethanamine
CID 103735457
2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine
CID 113446872
[1-(quinolin-6-ylmethyl)cyclopropyl]methanamine
CID 116997369
(1-benzylcycloheptyl)methanamine
CID 65391702
(1-benzylcyclooctyl)methanamine
CID 80602159
3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine
CID 104735900
3-(pyridin-3-ylmethyl)pyridine
CID 14762640

Frequently Asked Questions

What is the IUPAC name of [1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride?
The IUPAC name of [1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride (CID 86277054) is [1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride.
What is the SMILES notation for [1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride?
The canonical SMILES for [1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride is Cl.Cl.NCC1(Cc2cccnc2)CC1.
What is the InChIKey of [1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride?
The InChIKey is UNMUFXYRPXMUKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2.2ClH/c11-8-10(3-4-10)6-9-2-1-5-12-7-9;;/h1-2,5,7H,3-4,6,8,11H2;2*1H.
What are the key properties of [1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride?
[1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride has a molecular weight of 235.16 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride is sourced from PubChem (CID 86277054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).