2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide

C16H31N3O2 — CID 63909966

IUPAC2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide
SMILESCCN(CC1CCCO1)CC(NC(C)C)(C(N)=O)C1CC1
InChIInChI=1S/C16H31N3O2/c1-4-19(10-14-6-5-9-21-14)11-16(15(17)20,13-7-8-13)18-12(2)3/h12-14,18H,4-11H2,1-3H3,(H2,17,20)
InChIKeyPIRKQRAQVRAEBK-UHFFFAOYSA-N
MW297.44 g/mol
LogP1.12
Rot. Bonds9

About 2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide

2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide (PubChem CID 63909966) has the molecular formula C16H31N3O2 and a molecular weight of 297.44 g/mol. Its IUPAC name is 2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide
PubChem CID63909966
Molecular FormulaC16H31N3O2
Molecular Weight297.44 g/mol
Exact Mass297.24
IUPAC Name2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide
SMILESCCN(CC1CCCO1)CC(NC(C)C)(C(N)=O)C1CC1
InChIInChI=1S/C16H31N3O2/c1-4-19(10-14-6-5-9-21-14)11-16(15(17)20,13-7-8-13)18-12(2)3/h12-14,18H,4-11H2,1-3H3,(H2,17,20)
InChIKeyPIRKQRAQVRAEBK-UHFFFAOYSA-N
XLogP1.12
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
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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Related Compounds

2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]propanoic acid
CID 63909372
2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propan-1-ol
CID 64827702
2-cyclopropyl-3-[ethyl(2-methylbutyl)amino]-2-(propan-2-ylamino)propanamide
CID 79480286
2-cyclopropyl-3-[methyl(oxan-2-ylmethyl)amino]-2-(propylamino)propanamide
CID 63911732
2-amino-2-cyclopropyl-3-[methyl(oxolan-2-ylmethyl)amino]propanamide
CID 63911354
2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]propanenitrile
CID 63914205
2-cyclopropyl-3-[methyl-(1-methylpiperidin-3-yl)amino]-2-(propan-2-ylamino)propanamide
CID 63925394
2-acetamido-3-[ethyl(oxolan-2-ylmethyl)amino]propanoic acid
CID 64582510
3-[ethyl(oxolan-2-ylmethyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64826914
N-ethyl-2-(methylamino)-N-(oxolan-2-ylmethyl)propanamide
CID 62638434
methyl 2-(cyclopropylamino)-4-[ethyl(oxolan-2-ylmethyl)amino]butanoate
CID 63055508
2-cyclopropyl-2-(cyclopropylamino)-3-(oxolan-2-ylmethylsulfanyl)propanamide
CID 106495681

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide?
The IUPAC name of 2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide (CID 63909966) is 2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide.
What is the SMILES notation for 2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide?
The canonical SMILES for 2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide is CCN(CC1CCCO1)CC(NC(C)C)(C(N)=O)C1CC1.
What is the InChIKey of 2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide?
The InChIKey is PIRKQRAQVRAEBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O2/c1-4-19(10-14-6-5-9-21-14)11-16(15(17)20,13-7-8-13)18-12(2)3/h12-14,18H,4-11H2,1-3H3,(H2,17,20).
What are the key properties of 2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide?
2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide has a molecular weight of 297.44 g/mol, XLogP of 1.12, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-[ethyl(oxolan-2-ylmethyl)amino]-2-(propan-2-ylamino)propanamide is sourced from PubChem (CID 63909966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).