1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide

C16H24N2O2 — CID 119300012

IUPAC1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide
SMILESCc1cccc(OCC(C)NC(=O)C2(N)CCCC2)c1
InChIInChI=1S/C16H24N2O2/c1-12-6-5-7-14(10-12)20-11-13(2)18-15(19)16(17)8-3-4-9-16/h5-7,10,13H,3-4,8-9,11,17H2,1-2H3,(H,18,19)
InChIKeyBEQYAILEXAXOLD-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.15
Rot. Bonds5

About 1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide

1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide (PubChem CID 119300012) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide
PubChem CID119300012
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide
SMILESCc1cccc(OCC(C)NC(=O)C2(N)CCCC2)c1
InChIInChI=1S/C16H24N2O2/c1-12-6-5-7-14(10-12)20-11-13(2)18-15(19)16(17)8-3-4-9-16/h5-7,10,13H,3-4,8-9,11,17H2,1-2H3,(H,18,19)
InChIKeyBEQYAILEXAXOLD-UHFFFAOYSA-N
XLogP2.15
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N-[1-(3-methylphenoxy)propan-2-yl]piperidine-4-carboxamide
CID 119742824
N-[1-(3-methylphenoxy)propan-2-yl]pyrrolidine-1-carboxamide
CID 60568058
N-[(2R)-1-(3-methylphenoxy)propan-2-yl]pyrrolidine-1-carboxamide
CID 94503636
4-(aminomethyl)-N-[1-(3-methylphenoxy)propan-2-yl]benzamide
CID 119300010
1-amino-N-[1-(2,4-difluorophenoxy)propan-2-yl]cyclopentane-1-carboxamide
CID 119299978
2-amino-N-[1-(3-methylphenoxy)propan-2-yl]-2-(4-methylphenyl)acetamide
CID 120667713
1-amino-N-[1-(2,4-difluorophenoxy)propan-2-yl]cyclopentane-1-carboxamide;hydrochloride
CID 119299977
3-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclohexane-1-carboxamide
CID 119742802
N-[1-(3-methylphenoxy)propan-2-yl]-2-propan-2-ylsulfonylacetamide
CID 86828499
3-amino-N-[1-(3-methylphenoxy)propan-2-yl]-3-phenylpropanamide
CID 119950399
N-[1-(3-methylphenoxy)propan-2-yl]-1,1-dioxothiolane-3-carboxamide
CID 86828412
N-[1-(3-methylphenoxy)propan-2-yl]pyrrolidine-2-carboxamide;hydrochloride
CID 119300007

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide (CID 119300012) is 1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide is Cc1cccc(OCC(C)NC(=O)C2(N)CCCC2)c1.
What is the InChIKey of 1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide?
The InChIKey is BEQYAILEXAXOLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12-6-5-7-14(10-12)20-11-13(2)18-15(19)16(17)8-3-4-9-16/h5-7,10,13H,3-4,8-9,11,17H2,1-2H3,(H,18,19).
What are the key properties of 1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide?
1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[1-(3-methylphenoxy)propan-2-yl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119300012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).