2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine

C10H13N3 — CID 130140544

IUPAC2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine
SMILESNc1ccnc(N2CC3CC3C2)c1
InChIInChI=1S/C10H13N3/c11-9-1-2-12-10(4-9)13-5-7-3-8(7)6-13/h1-2,4,7-8H,3,5-6H2,(H2,11,12)
InChIKeyDCXNKEAYYFGNRB-UHFFFAOYSA-N
MW175.24 g/mol
LogP1.12
Rot. Bonds1

About 2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine

2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine (PubChem CID 130140544) has the molecular formula C10H13N3 and a molecular weight of 175.24 g/mol. Its IUPAC name is 2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine.

Molecular Properties

Compound Name2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine
PubChem CID130140544
Molecular FormulaC10H13N3
Molecular Weight175.24 g/mol
Exact Mass175.11
IUPAC Name2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine
SMILESNc1ccnc(N2CC3CC3C2)c1
InChIInChI=1S/C10H13N3/c11-9-1-2-12-10(4-9)13-5-7-3-8(7)6-13/h1-2,4,7-8H,3,5-6H2,(H2,11,12)
InChIKeyDCXNKEAYYFGNRB-UHFFFAOYSA-N
XLogP1.12
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.24
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S,5R)-3-(4-fluoro-2-pyridinyl)-3-azabicyclo[3.1.0]hexane
CID 142422250
2-(3,4,5-trimethylpiperazin-1-yl)pyridin-4-amine
CID 114543057
2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridine-4-carboxylic acid
CID 83832434
(3R)-1-(4-amino-2-pyridinyl)pyrrolidin-3-ol
CID 94895351
3-(4-fluoro-2-pyridinyl)-3-azabicyclo[3.1.0]hexane;N-methylidenehydroxylamine
CID 142422469
2-(4-cyclopentylpiperazin-1-yl)pyridin-4-amine
CID 62367922
2-[(3R)-3-methoxypiperidin-1-yl]pyridin-4-amine
CID 129413992
2-[3-(methoxymethyl)piperidin-1-yl]pyridin-4-amine
CID 106585882
2-[4-(2-methylpropyl)piperazin-1-yl]pyridin-4-amine
CID 62776997
[4-(3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]hydrazine
CID 130979615
2-[1-(4-amino-2-pyridinyl)piperidin-4-yl]oxyethanol
CID 82695712
4-(3-azabicyclo[3.1.0]hexan-3-yl)benzene-1,2-diamine
CID 131071375

Frequently Asked Questions

What is the IUPAC name of 2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine?
The IUPAC name of 2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine (CID 130140544) is 2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine.
What is the SMILES notation for 2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine?
The canonical SMILES for 2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine is Nc1ccnc(N2CC3CC3C2)c1.
What is the InChIKey of 2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine?
The InChIKey is DCXNKEAYYFGNRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c11-9-1-2-12-10(4-9)13-5-7-3-8(7)6-13/h1-2,4,7-8H,3,5-6H2,(H2,11,12).
What are the key properties of 2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine?
2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine has a molecular weight of 175.24 g/mol, XLogP of 1.12, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-azabicyclo[3.1.0]hexan-3-yl)pyridin-4-amine is sourced from PubChem (CID 130140544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).