N-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine

C14H21N — CID 164769540

IUPACN-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine
SMILESCC(C)C1(N(C)Cc2ccccc2)CC1
InChIInChI=1S/C14H21N/c1-12(2)14(9-10-14)15(3)11-13-7-5-4-6-8-13/h4-8,12H,9-11H2,1-3H3
InChIKeyYKJFAVBMIHPBDN-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.31
Rot. Bonds4

About N-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine

N-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine (PubChem CID 164769540) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is N-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine.

Molecular Properties

Compound NameN-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine
PubChem CID164769540
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC NameN-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine
SMILESCC(C)C1(N(C)Cc2ccccc2)CC1
InChIInChI=1S/C14H21N/c1-12(2)14(9-10-14)15(3)11-13-7-5-4-6-8-13/h4-8,12H,9-11H2,1-3H3
InChIKeyYKJFAVBMIHPBDN-UHFFFAOYSA-N
XLogP3.31
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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N,N-dimethyl-1-phenylmethanamine;hydrobromide
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N,N-dimethyl-1-phenylmethanamine;phosphane
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benzene;N,N-dimethyl-1-phenylmethanamine;ethane
CID 90785154
1-(aminomethyl)-N-benzyl-N,3-dimethylcyclohexan-1-amine
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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine?
The IUPAC name of N-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine (CID 164769540) is N-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine.
What is the SMILES notation for N-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine?
The canonical SMILES for N-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine is CC(C)C1(N(C)Cc2ccccc2)CC1.
What is the InChIKey of N-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine?
The InChIKey is YKJFAVBMIHPBDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-12(2)14(9-10-14)15(3)11-13-7-5-4-6-8-13/h4-8,12H,9-11H2,1-3H3.
What are the key properties of N-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine?
N-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.31, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-1-propan-2-ylcyclopropan-1-amine is sourced from PubChem (CID 164769540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).