N-benzyl-N-ethenylpropan-2-amine

C12H17N — CID 67948019

IUPACN-benzyl-N-ethenylpropan-2-amine
SMILESC=CN(Cc1ccccc1)C(C)C
InChIInChI=1S/C12H17N/c1-4-13(11(2)3)10-12-8-6-5-7-9-12/h4-9,11H,1,10H2,2-3H3
InChIKeyMVMCZRBJILPXNS-UHFFFAOYSA-N
MW175.27 g/mol
LogP3.04
Rot. Bonds4

About N-benzyl-N-ethenylpropan-2-amine

N-benzyl-N-ethenylpropan-2-amine (PubChem CID 67948019) has the molecular formula C12H17N and a molecular weight of 175.27 g/mol. Its IUPAC name is N-benzyl-N-ethenylpropan-2-amine.

Molecular Properties

Compound NameN-benzyl-N-ethenylpropan-2-amine
PubChem CID67948019
Molecular FormulaC12H17N
Molecular Weight175.27 g/mol
Exact Mass175.14
IUPAC NameN-benzyl-N-ethenylpropan-2-amine
SMILESC=CN(Cc1ccccc1)C(C)C
InChIInChI=1S/C12H17N/c1-4-13(11(2)3)10-12-8-6-5-7-9-12/h4-9,11H,1,10H2,2-3H3
InChIKeyMVMCZRBJILPXNS-UHFFFAOYSA-N
XLogP3.04
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.27
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[benzyl(ethenyl)amino]ethane-1,1,2-triol;hydrobromide
CID 174204817
N-benzyl-N-(4-methylhex-1-en-3-yl)hydroxylamine
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benzyl(ethenyl)carbamic acid
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1-N,1-N,1-N',1-N'-tetrabenzylprop-2-ene-1,1-diamine
CID 11144541
1-[3-aminopropyl(dimethoxy)silyl]oxy-N-benzyl-N-ethenylpropan-2-amine;hydrochloride
CID 140986490
N-benzyl-N-dimethylalumanylpropan-2-amine
CID 16696202
3-[benzyl(formyl)amino]-2-oxobutanoic acid
CID 139335016
N-benzyl-N-ethenylpropanamide
CID 11469541
N,N-dibenzyl-1-fluoropropan-2-amine
CID 70794652
2-[benzyl(prop-2-enyl)amino]propanoic acid
CID 119134454
N-benzyl-N-ethylethenesulfonamide
CID 130543897
N-benzyl-N-(2-bromoethyl)propan-2-amine
CID 61289329

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethenylpropan-2-amine?
The IUPAC name of N-benzyl-N-ethenylpropan-2-amine (CID 67948019) is N-benzyl-N-ethenylpropan-2-amine.
What is the SMILES notation for N-benzyl-N-ethenylpropan-2-amine?
The canonical SMILES for N-benzyl-N-ethenylpropan-2-amine is C=CN(Cc1ccccc1)C(C)C.
What is the InChIKey of N-benzyl-N-ethenylpropan-2-amine?
The InChIKey is MVMCZRBJILPXNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N/c1-4-13(11(2)3)10-12-8-6-5-7-9-12/h4-9,11H,1,10H2,2-3H3.
What are the key properties of N-benzyl-N-ethenylpropan-2-amine?
N-benzyl-N-ethenylpropan-2-amine has a molecular weight of 175.27 g/mol, XLogP of 3.04, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethenylpropan-2-amine is sourced from PubChem (CID 67948019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).