N-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine

C16H24N2 — CID 119124375

IUPACN-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine
SMILESC=C(C)CN1CCC(NCc2ccccc2)CC1
InChIInChI=1S/C16H24N2/c1-14(2)13-18-10-8-16(9-11-18)17-12-15-6-4-3-5-7-15/h3-7,16-17H,1,8-13H2,2H3
InChIKeyHNYMDHGTDJZPKS-UHFFFAOYSA-N
MW244.38 g/mol
LogP2.82
Rot. Bonds5

About N-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine

N-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine (PubChem CID 119124375) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is N-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine.

Molecular Properties

Compound NameN-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine
PubChem CID119124375
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC NameN-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine
SMILESC=C(C)CN1CCC(NCc2ccccc2)CC1
InChIInChI=1S/C16H24N2/c1-14(2)13-18-10-8-16(9-11-18)17-12-15-6-4-3-5-7-15/h3-7,16-17H,1,8-13H2,2H3
InChIKeyHNYMDHGTDJZPKS-UHFFFAOYSA-N
XLogP2.82
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[4-(benzylamino)piperidin-1-yl]-N-methylacetamide
CID 38056640
N-benzyl-1-methylpiperidin-4-amine
CID 1114650
1-(2-methylprop-2-enyl)-N-[(2-nitrophenyl)methyl]piperidin-4-amine
CID 119124367
1-(2-methylprop-2-enyl)-N-[(5-methylthiophen-2-yl)methyl]piperidin-4-amine
CID 119124373
N-[(1-methylbenzimidazol-2-yl)methyl]-1-(2-methylprop-2-enyl)piperidin-4-amine
CID 119124241
N-[1-(2-methylprop-2-enyl)piperidin-4-yl]benzenesulfonamide
CID 47017423
N-[(4-fluoro-2-methylphenyl)methyl]-1-(2-methylprop-2-enyl)piperidin-4-amine
CID 119124259
N-(cyclopropylmethyl)-1-(2-methylprop-2-enyl)piperidin-4-amine
CID 78946388
N-(1H-imidazol-2-ylmethyl)-1-(2-methylprop-2-enyl)piperidin-4-amine
CID 119126160
1-benzyl-N-[(4-phenylphenyl)methyl]piperidin-4-amine;dihydrochloride
CID 17159249
1-benzyl-N-[2-(2-methylprop-2-enoxy)ethyl]piperidin-4-amine
CID 115699248
4-(benzylamino)piperidine-1-carboxamide
CID 43757030

Frequently Asked Questions

What is the IUPAC name of N-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine?
The IUPAC name of N-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine (CID 119124375) is N-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine.
What is the SMILES notation for N-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine?
The canonical SMILES for N-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine is C=C(C)CN1CCC(NCc2ccccc2)CC1.
What is the InChIKey of N-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine?
The InChIKey is HNYMDHGTDJZPKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-14(2)13-18-10-8-16(9-11-18)17-12-15-6-4-3-5-7-15/h3-7,16-17H,1,8-13H2,2H3.
What are the key properties of N-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine?
N-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine has a molecular weight of 244.38 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1-(2-methylprop-2-enyl)piperidin-4-amine is sourced from PubChem (CID 119124375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).