3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide

C13H26N2O3 — CID 55005245

IUPAC3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide
SMILESCOCCN(C(=O)CCNC1CC1)C(C)COC
InChIInChI=1S/C13H26N2O3/c1-11(10-18-3)15(8-9-17-2)13(16)6-7-14-12-4-5-12/h11-12,14H,4-10H2,1-3H3
InChIKeyPTYKBWQUYFIMAW-UHFFFAOYSA-N
MW258.36 g/mol
LogP0.64
Rot. Bonds10

About 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide

3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide (PubChem CID 55005245) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide.

Molecular Properties

Compound Name3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide
PubChem CID55005245
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC Name3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide
SMILESCOCCN(C(=O)CCNC1CC1)C(C)COC
InChIInChI=1S/C13H26N2O3/c1-11(10-18-3)15(8-9-17-2)13(16)6-7-14-12-4-5-12/h11-12,14H,4-10H2,1-3H3
InChIKeyPTYKBWQUYFIMAW-UHFFFAOYSA-N
XLogP0.64
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(cyclopropylamino)-N-(2-methoxyethyl)-N-pentan-3-ylpropanamide
CID 54871842
3-(cyclopropylamino)-N-(2-methylpropyl)-N-pentan-3-ylpropanamide
CID 79491004
5-bromo-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pentanamide
CID 107909884
1-N-cyclopropyl-3-N-(2-methoxyethyl)-3-N-methylbutane-1,3-diamine
CID 62448035
2-methoxyethyl 3-(cyclopropylamino)propanoate
CID 61301679
1-N-cyclopropyl-4-N,4-N-bis(2-methoxyethyl)pentane-1,4-diamine
CID 62462661
3-[3-(cyclopropylamino)propanoyl-ethylamino]propanoic acid
CID 62328828
1-N-cyclopropyl-3-N-(2-methoxyethyl)-3-N-pentan-3-ylbutane-1,3-diamine
CID 55072403
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-piperidin-4-ylsulfanylacetamide
CID 114627353
5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-methyl-5-oxopentanoic acid
CID 62965265
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 65242273
2-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclobutan-1-amine
CID 80998461

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide?
The IUPAC name of 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide (CID 55005245) is 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide.
What is the SMILES notation for 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide?
The canonical SMILES for 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide is COCCN(C(=O)CCNC1CC1)C(C)COC.
What is the InChIKey of 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide?
The InChIKey is PTYKBWQUYFIMAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-11(10-18-3)15(8-9-17-2)13(16)6-7-14-12-4-5-12/h11-12,14H,4-10H2,1-3H3.
What are the key properties of 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide?
3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide has a molecular weight of 258.36 g/mol, XLogP of 0.64, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)propanamide is sourced from PubChem (CID 55005245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).