N-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine

C14H18N2 — CID 79508367

IUPACN-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine
SMILESc1ccc(C2CC2NC2=NCCCC2)cc1
InChIInChI=1S/C14H18N2/c1-2-6-11(7-3-1)12-10-13(12)16-14-8-4-5-9-15-14/h1-3,6-7,12-13H,4-5,8-10H2,(H,15,16)
InChIKeyAGULIFMTUFENDK-UHFFFAOYSA-N
MW214.31 g/mol
LogP2.71
Rot. Bonds2

About N-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine

N-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine (PubChem CID 79508367) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine.

Molecular Properties

Compound NameN-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine
PubChem CID79508367
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC NameN-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine
SMILESc1ccc(C2CC2NC2=NCCCC2)cc1
InChIInChI=1S/C14H18N2/c1-2-6-11(7-3-1)12-10-13(12)16-14-8-4-5-9-15-14/h1-3,6-7,12-13H,4-5,8-10H2,(H,15,16)
InChIKeyAGULIFMTUFENDK-UHFFFAOYSA-N
XLogP2.71
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S)-2-phenylcyclopentyl]-1-azacyclotridecen-2-amine
CID 90221273
N-[(1R,2R)-2-phenylcyclopentyl]-2,3,4,5,6,7-hexahydroazocin-8-amine;hydrochloride
CID 70053431
N-[(1R,2S)-2-phenylcycloheptyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine;hydrochloride
CID 70051755
N-[(1R,2S)-2-phenylcyclopropyl]-1,4,5,6-tetrahydropyrimidin-2-amine
CID 120665878
2-phenyl-1-(2,3,4,5-tetrahydropyridin-6-ylamino)cyclopentan-1-ol
CID 54553270
1-(3,4-dihydro-2H-pyrrol-5-yl)-2-phenylhydrazine
CID 11231519
5-fluoro-N-(2-phenylcyclopropyl)pyrimidin-2-amine
CID 112703145
N-(2-bicyclo[2.2.1]heptanyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 79504363
cyclopropyl-phenyl-(2,3,4,5-tetrahydropyridin-6-ylamino)methanol
CID 54048321
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 97170591
3-N-(2-phenylcyclopropyl)pyrazine-2,3-diamine
CID 113228947
6-chloro-N-(2-phenylcyclopropyl)pyridin-2-amine
CID 63586356

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine?
The IUPAC name of N-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine (CID 79508367) is N-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine.
What is the SMILES notation for N-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine?
The canonical SMILES for N-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine is c1ccc(C2CC2NC2=NCCCC2)cc1.
What is the InChIKey of N-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine?
The InChIKey is AGULIFMTUFENDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-2-6-11(7-3-1)12-10-13(12)16-14-8-4-5-9-15-14/h1-3,6-7,12-13H,4-5,8-10H2,(H,15,16).
What are the key properties of N-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine?
N-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine has a molecular weight of 214.31 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylcyclopropyl)-2,3,4,5-tetrahydropyridin-6-amine is sourced from PubChem (CID 79508367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).