5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile

C13H15N3 — CID 103837573

IUPAC5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile
SMILESN#Cc1ccc(NCC2(C3CC3)CC2)cn1
InChIInChI=1S/C13H15N3/c14-7-11-3-4-12(8-15-11)16-9-13(5-6-13)10-1-2-10/h3-4,8,10,16H,1-2,5-6,9H2
InChIKeyMPGIGYTYBNKYNX-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.56
Rot. Bonds4

About 5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile

5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile (PubChem CID 103837573) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile
PubChem CID103837573
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile
SMILESN#Cc1ccc(NCC2(C3CC3)CC2)cn1
InChIInChI=1S/C13H15N3/c14-7-11-3-4-12(8-15-11)16-9-13(5-6-13)10-1-2-10/h3-4,8,10,16H,1-2,5-6,9H2
InChIKeyMPGIGYTYBNKYNX-UHFFFAOYSA-N
XLogP2.56
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 2485743
[3,4'-Bipyridine]-3',5'-dicarbonitrile, 1',4'-dihydro-2',6'-dimethyl-
CID 854348
N-((pyridin-2-yl)methyl)cyclopropanamine
CID 1080491
3-Aminopyridine-2-carbonitrile
CID 577015
2-[1-(Pyridin-3-ylamino)ethylidene]propanedinitrile
CID 4868616
5-Aminopyridine-2-carbonitrile
CID 3871395
5-Amino-3-(trifluoromethyl)pyridine-2-carbonitrile
CID 13532246
2-Cyclopropylpyridine-3-carbonitrile
CID 57440906
3-(Methylamino)pyridine-2-carbonitrile
CID 67294260
2,6-Dimethyl-4-(4-pyridyl)-1,4-dihydropyridine-3,5-dicarbonitrile
CID 12558908
5-[(4-Fluorophenyl)methylamino]pyridine-2-carbonitrile
CID 12640234
US9676701, 12 4-(5-((trans)-2-aminocyclopropyl)pyridin-2-yl)benzonitrile dihydrochloride
CID 56652970

Frequently Asked Questions

What is the IUPAC name of 5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile?
The IUPAC name of 5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile (CID 103837573) is 5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile.
What is the SMILES notation for 5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile?
The canonical SMILES for 5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile is N#Cc1ccc(NCC2(C3CC3)CC2)cn1.
What is the InChIKey of 5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile?
The InChIKey is MPGIGYTYBNKYNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c14-7-11-3-4-12(8-15-11)16-9-13(5-6-13)10-1-2-10/h3-4,8,10,16H,1-2,5-6,9H2.
What are the key properties of 5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile?
5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile has a molecular weight of 213.28 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1-cyclopropylcyclopropyl)methylamino]pyridine-2-carbonitrile is sourced from PubChem (CID 103837573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).