N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine

C10H18N4 — CID 107488805

IUPACN-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESC1=C(CCNC2=NCCN2)CCNC1
InChIInChI=1S/C10H18N4/c1-4-11-5-2-9(1)3-6-12-10-13-7-8-14-10/h1,11H,2-8H2,(H2,12,13,14)
InChIKeyYCCFAACGXOXRAW-UHFFFAOYSA-N
MW194.28 g/mol
LogP-0.16
Rot. Bonds3

About N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine

N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 107488805) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine
PubChem CID107488805
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC NameN-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESC1=C(CCNC2=NCCN2)CCNC1
InChIInChI=1S/C10H18N4/c1-4-11-5-2-9(1)3-6-12-10-13-7-8-14-10/h1,11H,2-8H2,(H2,12,13,14)
InChIKeyYCCFAACGXOXRAW-UHFFFAOYSA-N
XLogP-0.16
TPSA48.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 5-0.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(5-Aminopentyl)-3-(4-methylpent-3-en-1-yl)guanidine
CID 129661483
N,N'-dimethyl-3-[2-(methylamino)propyl]-2,5-dihydropyrrole-1-carboximidamide
CID 59878537
N-(4,5-dihydro-1H-imidazol-2-yl)-N'-[(2R)-6-methylhept-5-en-2-yl]butane-1,4-diamine
CID 121451192
N-[(6-methylcyclohexa-1,5-dien-1-yl)methyl]-4,5-dihydro-1H-imidazol-2-amine
CID 146653890
N-[2-(cyclohexen-1-yl)ethyl]-4,5-dihydro-1H-imidazol-3-ium-2-amine chloride
CID 11117857
N-[2-(cyclohexen-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine
CID 11117858
N-[2-(cyclopenten-1-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine
CID 103842900
1-[2-(Cyclohexen-1-yl)ethyl]-3-[2-[ethyl(methyl)amino]ethyl]-2-methylguanidine;hydroiodide
CID 111208205
1-[2-(Cyclohexen-1-yl)ethyl]-3-[2-[ethyl(methyl)amino]ethyl]-2-methylguanidine
CID 111208206
N-(1,2,3,6-tetrahydropyridin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine
CID 114694366
1-cyclopentyl-2-[(1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl]guanidine;hydroiodide
CID 120190239
1-cyclopentyl-2-[(1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl]guanidine
CID 120190240

Frequently Asked Questions

What is the IUPAC name of N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine (CID 107488805) is N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine is C1=C(CCNC2=NCCN2)CCNC1.
What is the InChIKey of N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is YCCFAACGXOXRAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-4-11-5-2-9(1)3-6-12-10-13-7-8-14-10/h1,11H,2-8H2,(H2,12,13,14).
What are the key properties of N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine?
N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 194.28 g/mol, XLogP of -0.16, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 107488805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).