1-(2-phenylcyclopropyl)propan-1-amine

C12H17N — CID 116517334

IUPAC1-(2-phenylcyclopropyl)propan-1-amine
SMILESCCC(N)C1CC1c1ccccc1
InChIInChI=1S/C12H17N/c1-2-12(13)11-8-10(11)9-6-4-3-5-7-9/h3-7,10-12H,2,8,13H2,1H3
InChIKeyQDDRUBVYTLMDLA-UHFFFAOYSA-N
MW175.28 g/mol
LogP2.53
Rot. Bonds3

About 1-(2-phenylcyclopropyl)propan-1-amine

1-(2-phenylcyclopropyl)propan-1-amine (PubChem CID 116517334) has the molecular formula C12H17N and a molecular weight of 175.28 g/mol. Its IUPAC name is 1-(2-phenylcyclopropyl)propan-1-amine.

Molecular Properties

Compound Name1-(2-phenylcyclopropyl)propan-1-amine
PubChem CID116517334
Molecular FormulaC12H17N
Molecular Weight175.28 g/mol
Exact Mass175.14
IUPAC Name1-(2-phenylcyclopropyl)propan-1-amine
SMILESCCC(N)C1CC1c1ccccc1
InChIInChI=1S/C12H17N/c1-2-12(13)11-8-10(11)9-6-4-3-5-7-9/h3-7,10-12H,2,8,13H2,1H3
InChIKeyQDDRUBVYTLMDLA-UHFFFAOYSA-N
XLogP2.53
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.28
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-methyl-1-(2-phenylcyclopropyl)butan-1-amine
CID 116517331
[(1S,2R)-2-butan-2-ylcyclopropyl]benzene
CID 100977404
1-[(1R,2S)-2-phenylcyclopropyl]ethanamine
CID 57373127
3-methyl-1-(2-phenylcyclopropyl)hexan-1-amine
CID 115845595
2-(1-butan-2-ylpyrazol-3-yl)-1-(2-phenylcyclopropyl)ethanamine
CID 104989817
[2-methyl-1-(2-phenylcyclopropyl)butyl]hydrazine
CID 105219816
3-(2-phenylcyclopropyl)butan-1-amine
CID 116518610
2-ethoxy-2-phenyl-1-(2-phenylcyclopropyl)ethanamine
CID 116773370
4-methoxy-4-methyl-1-(2-phenylcyclopropyl)pentan-1-amine
CID 103031750
2-N,2-N,2-trimethyl-1-(2-phenylcyclopropyl)butane-1,2-diamine
CID 116517679
2-[(1S,2S)-2-phenylcyclopropyl]propan-1-ol
CID 130128748
3-ethyl-N-methyl-1-(2-phenylcyclopropyl)pentan-1-amine
CID 105028477

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenylcyclopropyl)propan-1-amine?
The IUPAC name of 1-(2-phenylcyclopropyl)propan-1-amine (CID 116517334) is 1-(2-phenylcyclopropyl)propan-1-amine.
What is the SMILES notation for 1-(2-phenylcyclopropyl)propan-1-amine?
The canonical SMILES for 1-(2-phenylcyclopropyl)propan-1-amine is CCC(N)C1CC1c1ccccc1.
What is the InChIKey of 1-(2-phenylcyclopropyl)propan-1-amine?
The InChIKey is QDDRUBVYTLMDLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N/c1-2-12(13)11-8-10(11)9-6-4-3-5-7-9/h3-7,10-12H,2,8,13H2,1H3.
What are the key properties of 1-(2-phenylcyclopropyl)propan-1-amine?
1-(2-phenylcyclopropyl)propan-1-amine has a molecular weight of 175.28 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenylcyclopropyl)propan-1-amine is sourced from PubChem (CID 116517334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).