1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide

C16H31N3O2 — CID 79565485

IUPAC1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide
SMILESCCN(CCOC)CCC1CCCC1(NC1CC1)C(N)=O
InChIInChI=1S/C16H31N3O2/c1-3-19(11-12-21-2)10-8-13-5-4-9-16(13,15(17)20)18-14-6-7-14/h13-14,18H,3-12H2,1-2H3,(H2,17,20)
InChIKeyUTJZGANLMZZUJO-UHFFFAOYSA-N
MW297.44 g/mol
LogP1.12
Rot. Bonds10

About 1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide

1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide (PubChem CID 79565485) has the molecular formula C16H31N3O2 and a molecular weight of 297.44 g/mol. Its IUPAC name is 1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide
PubChem CID79565485
Molecular FormulaC16H31N3O2
Molecular Weight297.44 g/mol
Exact Mass297.24
IUPAC Name1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide
SMILESCCN(CCOC)CCC1CCCC1(NC1CC1)C(N)=O
InChIInChI=1S/C16H31N3O2/c1-3-19(11-12-21-2)10-8-13-5-4-9-16(13,15(17)20)18-14-6-7-14/h13-14,18H,3-12H2,1-2H3,(H2,17,20)
InChIKeyUTJZGANLMZZUJO-UHFFFAOYSA-N
XLogP1.12
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.44
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide (CID 79565485) is 1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide is CCN(CCOC)CCC1CCCC1(NC1CC1)C(N)=O.
What is the InChIKey of 1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide?
The InChIKey is UTJZGANLMZZUJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O2/c1-3-19(11-12-21-2)10-8-13-5-4-9-16(13,15(17)20)18-14-6-7-14/h13-14,18H,3-12H2,1-2H3,(H2,17,20).
What are the key properties of 1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide?
1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide has a molecular weight of 297.44 g/mol, XLogP of 1.12, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 79565485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).