N-cyclopentyloxy-1-phenylpropan-1-amine

C14H21NO — CID 83228943

IUPACN-cyclopentyloxy-1-phenylpropan-1-amine
SMILESCCC(NOC1CCCC1)c1ccccc1
InChIInChI=1S/C14H21NO/c1-2-14(12-8-4-3-5-9-12)15-16-13-10-6-7-11-13/h3-5,8-9,13-15H,2,6-7,10-11H2,1H3
InChIKeyYQWZSHMVFLXYEU-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.60
Rot. Bonds5

About N-cyclopentyloxy-1-phenylpropan-1-amine

N-cyclopentyloxy-1-phenylpropan-1-amine (PubChem CID 83228943) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is N-cyclopentyloxy-1-phenylpropan-1-amine.

Molecular Properties

Compound NameN-cyclopentyloxy-1-phenylpropan-1-amine
PubChem CID83228943
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC NameN-cyclopentyloxy-1-phenylpropan-1-amine
SMILESCCC(NOC1CCCC1)c1ccccc1
InChIInChI=1S/C14H21NO/c1-2-14(12-8-4-3-5-9-12)15-16-13-10-6-7-11-13/h3-5,8-9,13-15H,2,6-7,10-11H2,1H3
InChIKeyYQWZSHMVFLXYEU-UHFFFAOYSA-N
XLogP3.60
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[1-(cyclopentyloxyamino)propyl]phenol
CID 83229678
(1S)-1-phenyl-N-propan-2-ylpropan-1-amine
CID 14387504
1-cyclopentyloxy-3-(1-phenylpropylamino)propan-2-ol
CID 62306417
N-cyclopentyloxy-1-phenylpropan-2-amine
CID 83229011
N-(cyclohexylmethyl)-2-ethyl-1-phenylbutan-1-amine
CID 43734674
2-(cyclohexylamino)-N-(1-phenylpropyl)acetamide
CID 54816670
N-(2-cyclopentyloxyethyl)-1-phenylbutan-1-amine
CID 63824425
N-(1-cyclopropylethyl)-1-phenylpropan-1-amine
CID 43533329
[2-(1-phenylpropylamino)cyclohexyl]methanol
CID 113261894
2-methylsulfonyl-N-(1-phenylpropyl)cyclopentan-1-amine
CID 65046271
1-cyclohexyl-3-(1-phenylpropyl)thiourea
CID 17281987
N-(2-cycloheptyl-1-phenylethyl)propan-1-amine
CID 114457602

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyloxy-1-phenylpropan-1-amine?
The IUPAC name of N-cyclopentyloxy-1-phenylpropan-1-amine (CID 83228943) is N-cyclopentyloxy-1-phenylpropan-1-amine.
What is the SMILES notation for N-cyclopentyloxy-1-phenylpropan-1-amine?
The canonical SMILES for N-cyclopentyloxy-1-phenylpropan-1-amine is CCC(NOC1CCCC1)c1ccccc1.
What is the InChIKey of N-cyclopentyloxy-1-phenylpropan-1-amine?
The InChIKey is YQWZSHMVFLXYEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-2-14(12-8-4-3-5-9-12)15-16-13-10-6-7-11-13/h3-5,8-9,13-15H,2,6-7,10-11H2,1H3.
What are the key properties of N-cyclopentyloxy-1-phenylpropan-1-amine?
N-cyclopentyloxy-1-phenylpropan-1-amine has a molecular weight of 219.33 g/mol, XLogP of 3.60, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyloxy-1-phenylpropan-1-amine is sourced from PubChem (CID 83228943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).