N-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine

C10H16N2 — CID 163469706

IUPACN-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine
SMILESC1=CN/C(=N/C2CCCC2)CC1
InChIInChI=1S/C10H16N2/c1-2-6-9(5-1)12-10-7-3-4-8-11-10/h4,8-9H,1-3,5-7H2,(H,11,12)
InChIKeyBVOAFGQQOIVVEQ-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.22
Rot. Bonds1

About N-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine

N-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine (PubChem CID 163469706) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is N-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine.

Molecular Properties

Compound NameN-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine
PubChem CID163469706
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC NameN-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine
SMILESC1=CN/C(=N/C2CCCC2)CC1
InChIInChI=1S/C10H16N2/c1-2-6-9(5-1)12-10-7-3-4-8-11-10/h4,8-9H,1-3,5-7H2,(H,11,12)
InChIKeyBVOAFGQQOIVVEQ-UHFFFAOYSA-N
XLogP2.22
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-propan-2-yl-3,4-dihydro-1H-pyridin-2-imine
CID 136010361
N-pentyl-1,3-dihydropyrrol-2-imine
CID 136470177
N-butyl-3,4-dihydro-1H-pyridin-2-imine
CID 143913747
N-[[(2S)-pyrrolidin-2-yl]methyl]-3,4-dihydro-1H-pyridin-2-imine
CID 144768522
Ethane;2-ethyl-4-methyl-1,4-dihydropyrimidine
CID 145622546
2,4-dibutyl-1-methyl-1H-imidazol-1-ium
CID 158553687
N-pent-4-en-2-yl-2,3,4,5-tetrahydropyridin-6-amine
CID 116040191
2-N-piperidin-4-yl-1,4-dihydropyridine-2,3-diimine
CID 136431746
N-[(E)-but-1-enyl]-2-(6-ethyl-1,4,5,6-tetrahydropyrimidin-2-yl)-N'-[(E)-prop-1-enyl]ethanimidamide
CID 142031741

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine?
The IUPAC name of N-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine (CID 163469706) is N-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine.
What is the SMILES notation for N-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine?
The canonical SMILES for N-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine is C1=CN/C(=N/C2CCCC2)CC1.
What is the InChIKey of N-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine?
The InChIKey is BVOAFGQQOIVVEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-2-6-9(5-1)12-10-7-3-4-8-11-10/h4,8-9H,1-3,5-7H2,(H,11,12).
What are the key properties of N-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine?
N-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine has a molecular weight of 164.25 g/mol, XLogP of 2.22, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3,4-dihydro-1H-pyridin-2-imine is sourced from PubChem (CID 163469706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).