2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide

C14H29N3O2 — CID 63055154

IUPAC2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide
SMILESCOCCN(CCC(NC1CC1)C(N)=O)CC(C)C
InChIInChI=1S/C14H29N3O2/c1-11(2)10-17(8-9-19-3)7-6-13(14(15)18)16-12-4-5-12/h11-13,16H,4-10H2,1-3H3,(H2,15,18)
InChIKeyPKNUHRQBDYMDFZ-UHFFFAOYSA-N
MW271.40 g/mol
LogP0.59
Rot. Bonds11

About 2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide

2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide (PubChem CID 63055154) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is 2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide
PubChem CID63055154
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC Name2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide
SMILESCOCCN(CCC(NC1CC1)C(N)=O)CC(C)C
InChIInChI=1S/C14H29N3O2/c1-11(2)10-17(8-9-19-3)7-6-13(14(15)18)16-12-4-5-12/h11-13,16H,4-10H2,1-3H3,(H2,15,18)
InChIKeyPKNUHRQBDYMDFZ-UHFFFAOYSA-N
XLogP0.59
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclopropylamino)-4-[ethyl(2-methylpropyl)amino]butanamide
CID 55143527
2-(cyclopropylamino)-4-[1-methoxypropan-2-yl(methyl)amino]butanamide
CID 63053045
methyl 2-(cyclopropylamino)-4-[methyl(2-methylpropyl)amino]butanoate
CID 63028809
2-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butanoic acid
CID 63055687
1-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butan-2-ol
CID 64822021
2-(cyclopropylamino)-3-[2-ethoxyethyl(ethyl)amino]propanamide
CID 63691582
methyl 3-[bis(2-methoxyethyl)amino]-2-methylpropanoate
CID 60649296
4-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-2-(methylamino)butanamide
CID 63053033
ethyl 2-amino-4-[2-methoxyethyl(2-methylpropyl)amino]butanoate
CID 63053393
2-(cyclopropylamino)-3-[methyl(2-propan-2-yloxyethyl)amino]propanamide
CID 81073752
2-(cyclopentylamino)-3-methoxypropanamide
CID 115924491
2-[2-methoxyethyl(2-methylpropyl)amino]propanamide
CID 62901426

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide?
The IUPAC name of 2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide (CID 63055154) is 2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide.
What is the SMILES notation for 2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide?
The canonical SMILES for 2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide is COCCN(CCC(NC1CC1)C(N)=O)CC(C)C.
What is the InChIKey of 2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide?
The InChIKey is PKNUHRQBDYMDFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2/c1-11(2)10-17(8-9-19-3)7-6-13(14(15)18)16-12-4-5-12/h11-13,16H,4-10H2,1-3H3,(H2,15,18).
What are the key properties of 2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide?
2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide has a molecular weight of 271.40 g/mol, XLogP of 0.59, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-4-[2-methoxyethyl(2-methylpropyl)amino]butanamide is sourced from PubChem (CID 63055154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).