N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine

C12H22N4 — CID 114400593

IUPACN-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESC1CNC(N(CC2CCNCC2)C2CC2)=N1
InChIInChI=1S/C12H22N4/c1-2-11(1)16(12-14-7-8-15-12)9-10-3-5-13-6-4-10/h10-11,13H,1-9H2,(H,14,15)
InChIKeyUHCKVDMEMHZDBC-UHFFFAOYSA-N
MW222.34 g/mol
LogP0.41
Rot. Bonds3

About N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine

N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 114400593) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID114400593
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC NameN-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESC1CNC(N(CC2CCNCC2)C2CC2)=N1
InChIInChI=1S/C12H22N4/c1-2-11(1)16(12-14-7-8-15-12)9-10-3-5-13-6-4-10/h10-11,13H,1-9H2,(H,14,15)
InChIKeyUHCKVDMEMHZDBC-UHFFFAOYSA-N
XLogP0.41
TPSA39.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-N-(piperidin-4-ylmethyl)pyrimidin-2-amine
CID 79720212
3-bromo-N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)pyridin-2-amine
CID 106876188
3-[cyclopropyl(piperidin-4-ylmethyl)amino]pyrazine-2-carbonitrile
CID 79719645
N-cyclopropyl-N-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104732739
N-cyclopropyl-4-methyl-N-(piperidin-4-ylmethyl)-1,3-thiazol-2-amine
CID 79719436
N-cyclopropyl-6-ethoxy-N-(piperidin-4-ylmethyl)pyridin-2-amine
CID 79719364
N-cyclopropyl-N-(piperidin-4-ylmethyl)cyclobutanamine
CID 79716019
N-(2-bromophenyl)-N-(cyclopropylmethyl)-4,5-dihydro-1H-imidazol-2-amine
CID 12674643
N-cyclopropyl-3-nitro-N-(piperidin-4-ylmethyl)aniline
CID 79705735
N-phenyl-N-(piperidin-4-ylmethyl)-2,3-dihydro-1H-inden-2-amine
CID 123700312
N-cyclopropyl-1-methyl-N-(piperidin-4-ylmethyl)pyrazolo[5,4-d]pyrimidin-4-amine
CID 79705738
5-[cyclopropyl(piperidin-4-ylmethyl)amino]-1,3-dimethylpyrazole-4-carbonitrile
CID 79719216

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine (CID 114400593) is N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine is C1CNC(N(CC2CCNCC2)C2CC2)=N1.
What is the InChIKey of N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is UHCKVDMEMHZDBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-2-11(1)16(12-14-7-8-15-12)9-10-3-5-13-6-4-10/h10-11,13H,1-9H2,(H,14,15).
What are the key properties of N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine?
N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 222.34 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(piperidin-4-ylmethyl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 114400593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).