methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine

C18H29N3 — CID 145176283

IUPACmethanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine
SMILESC(=C/C1CC1NCC1CCNCC1)\c1ccccc1.CN
InChIInChI=1S/C17H24N2.CH5N/c1-2-4-14(5-3-1)6-7-16-12-17(16)19-13-15-8-10-18-11-9-15;1-2/h1-7,15-19H,8-13H2;2H2,1H3/b7-6+;
InChIKeyVKFKFKKBOHOYRW-UHDJGPCESA-N
MW287.45 g/mol
LogP2.25
Rot. Bonds5

About methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine

methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine (PubChem CID 145176283) has the molecular formula C18H29N3 and a molecular weight of 287.45 g/mol. Its IUPAC name is methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine.

Molecular Properties

Compound Namemethanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine
PubChem CID145176283
Molecular FormulaC18H29N3
Molecular Weight287.45 g/mol
Exact Mass287.24
IUPAC Namemethanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine
SMILESC(=C/C1CC1NCC1CCNCC1)\c1ccccc1.CN
InChIInChI=1S/C17H24N2.CH5N/c1-2-4-14(5-3-1)6-7-16-12-17(16)19-13-15-8-10-18-11-9-15;1-2/h1-7,15-19H,8-13H2;2H2,1H3/b7-6+;
InChIKeyVKFKFKKBOHOYRW-UHDJGPCESA-N
XLogP2.25
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 52.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-phenylethenyl)-N-(piperidin-4-ylmethyl)cyclopropan-1-amine;dihydrochloride
CID 153307593
2-methyl-1-[4-[[[2-[(E)-2-phenylethenyl]cyclopropyl]amino]methyl]piperidin-1-yl]propan-2-ol;bis(2,2,2-trifluoroacetic acid)
CID 138677639
2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)aziridin-1-amine
CID 138712121
tert-butyl 4-[[[2-[(E)-2-(2-fluorophenyl)ethenyl]cyclopropyl]amino]methyl]piperidine-1-carboxylate;tert-butyl formate;2-[(E)-2-(2-fluorophenyl)ethenyl]cyclopropan-1-amine;2-[(E)-2-(2-fluorophenyl)ethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine;piperidine-4-carbaldehyde
CID 159396076
2-[(E)-2-phenylethenyl]cyclopropan-1-amine
CID 122640920
2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride
CID 122640919
2-(4-phenylmethoxyphenyl)-N-(piperidin-4-ylmethyl)cyclopropan-1-amine
CID 78097199
(3S)-3-methyl-5-[(Z)-2-phenylethenyl]azepane
CID 142892623
2-(4,4-dimethylpentyl)-N'-ethenyl-2-fluoro-N-[2-[(E)-2-phenylethenyl]cyclopropyl]butane-1,4-diamine
CID 138711219
N-[[1-(benzenesulfonyl)piperidin-4-yl]methyl]-5-methylazepan-4-amine
CID 128873847
4-[(E)-2-(4-benzylphenyl)ethenyl]piperidine;ethane
CID 143194772
tert-butyl formate;trans-(1R,2S)-N-(azetidin-3-ylmethyl)-2-phenylcyclopropan-1-amine
CID 174838718

Frequently Asked Questions

What is the IUPAC name of methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine?
The IUPAC name of methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine (CID 145176283) is methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine.
What is the SMILES notation for methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine?
The canonical SMILES for methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine is C(=C/C1CC1NCC1CCNCC1)\c1ccccc1.CN.
What is the InChIKey of methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine?
The InChIKey is VKFKFKKBOHOYRW-UHDJGPCESA-N. The full InChI is InChI=1S/C17H24N2.CH5N/c1-2-4-14(5-3-1)6-7-16-12-17(16)19-13-15-8-10-18-11-9-15;1-2/h1-7,15-19H,8-13H2;2H2,1H3/b7-6+;.
What are the key properties of methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine?
methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine has a molecular weight of 287.45 g/mol, XLogP of 2.25, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methanamine;2-[(E)-2-phenylethenyl]-N-(piperidin-4-ylmethyl)cyclopropan-1-amine is sourced from PubChem (CID 145176283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).