3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide

C14H28N2O2 — CID 54871842

IUPAC3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide
SMILESCCC(CC)N(CCOC)C(=O)CCNC1CC1
InChIInChI=1S/C14H28N2O2/c1-4-13(5-2)16(10-11-18-3)14(17)8-9-15-12-6-7-12/h12-13,15H,4-11H2,1-3H3
InChIKeyFBQLWEAYZVXXAS-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.79
Rot. Bonds10

About 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide

3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide (PubChem CID 54871842) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide.

Molecular Properties

Compound Name3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide
PubChem CID54871842
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide
SMILESCCC(CC)N(CCOC)C(=O)CCNC1CC1
InChIInChI=1S/C14H28N2O2/c1-4-13(5-2)16(10-11-18-3)14(17)8-9-15-12-6-7-12/h12-13,15H,4-11H2,1-3H3
InChIKeyFBQLWEAYZVXXAS-UHFFFAOYSA-N
XLogP1.79
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide
CID 55005245
3-(cyclopropylamino)-N-(2-methylpropyl)-N-pentan-3-ylpropanamide
CID 79491004
N-(2-methoxyethyl)-N-pentan-3-yl-4-(propan-2-ylamino)butanamide
CID 54871818
1-N-cyclopropyl-4-N-(2-methoxyethyl)-4-N-pentan-3-ylpentane-1,4-diamine
CID 62449357
1-N-cyclopropyl-3-N-(2-methoxyethyl)-3-N-pentan-3-ylbutane-1,3-diamine
CID 55072403
N-cyclopentyl-N'-(2-methoxyethyl)-N'-pentan-3-ylpropane-1,3-diamine
CID 62562576
2-methoxyethyl 3-(cyclopropylamino)propanoate
CID 61301679
3-[3-(cyclopropylamino)propanoyl-ethylamino]propanoic acid
CID 62328828
1-N-cyclopropyl-4-N,4-N-bis(2-methoxyethyl)pentane-1,4-diamine
CID 62462661
N-(2-methoxyethyl)-2-[1-(methylamino)cyclohexyl]-N-pentan-3-ylacetamide
CID 65242111
1-N-cyclopropyl-3-N-(2-methoxyethyl)-3-N-methylbutane-1,3-diamine
CID 62448035
2-(2-aminoethoxy)-N-(2-methoxyethyl)-N-pentan-3-ylacetamide
CID 79474034

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide?
The IUPAC name of 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide (CID 54871842) is 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide.
What is the SMILES notation for 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide?
The canonical SMILES for 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide is CCC(CC)N(CCOC)C(=O)CCNC1CC1.
What is the InChIKey of 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide?
The InChIKey is FBQLWEAYZVXXAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-4-13(5-2)16(10-11-18-3)14(17)8-9-15-12-6-7-12/h12-13,15H,4-11H2,1-3H3.
What are the key properties of 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide?
3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide has a molecular weight of 256.39 g/mol, XLogP of 1.79, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide is sourced from PubChem (CID 54871842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).