4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide

C14H26N2O2 — CID 114285592

IUPAC4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide
SMILESCC(C)(CCN)C(=O)N(CC1CCOC1)C1CC1
InChIInChI=1S/C14H26N2O2/c1-14(2,6-7-15)13(17)16(12-3-4-12)9-11-5-8-18-10-11/h11-12H,3-10,15H2,1-2H3
InChIKeyPIJAPJBWTHDQRL-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.39
Rot. Bonds6

About 4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide

4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide (PubChem CID 114285592) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide
PubChem CID114285592
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide
SMILESCC(C)(CCN)C(=O)N(CC1CCOC1)C1CC1
InChIInChI=1S/C14H26N2O2/c1-14(2,6-7-15)13(17)16(12-3-4-12)9-11-5-8-18-10-11/h11-12H,3-10,15H2,1-2H3
InChIKeyPIJAPJBWTHDQRL-UHFFFAOYSA-N
XLogP1.39
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-N-cyclopropyl-N-(oxolan-3-ylmethyl)cyclopropane-1-carboxamide
CID 115452951
1-cyclopropyl-3-ethyl-1-(oxolan-3-ylmethyl)urea
CID 71940583
1-cyclopropyl-3-ethyl-1-[[(3R)-oxolan-3-yl]methyl]urea
CID 97028885
N-cyclopropyl-2-[(2-methylpropan-2-yl)oxy]-N-(oxolan-3-ylmethyl)acetamide
CID 112604701
(2S)-2-amino-N-[2-[cyclopropyl(oxolan-3-ylmethyl)amino]-2-oxoethyl]-3-methylbutanamide
CID 82963767
N-cyclopropyl-N-(oxolan-3-ylmethyl)piperidine-4-carboxamide;hydrochloride
CID 119284851
N-ethyl-2-methyl-2-(methylamino)-N-(oxolan-3-ylmethyl)propanamide
CID 62845627
2-[1-(aminomethyl)cyclohexyl]-N-cyclopropyl-N-(oxolan-3-ylmethyl)acetamide
CID 104677867
4-amino-N-cyclopropyl-N-(oxolan-3-ylmethyl)benzamide
CID 54904600
5-[cyclopropyl(oxolan-3-ylmethyl)amino]-3-methyl-5-oxopentanoic acid
CID 62963883
6-[cyclopropyl(oxolan-3-ylmethyl)amino]-6-oxohexanoic acid
CID 54876447
3-amino-N-cyclopropyl-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119715175

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide?
The IUPAC name of 4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide (CID 114285592) is 4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide.
What is the SMILES notation for 4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide?
The canonical SMILES for 4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide is CC(C)(CCN)C(=O)N(CC1CCOC1)C1CC1.
What is the InChIKey of 4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide?
The InChIKey is PIJAPJBWTHDQRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-14(2,6-7-15)13(17)16(12-3-4-12)9-11-5-8-18-10-11/h11-12H,3-10,15H2,1-2H3.
What are the key properties of 4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide?
4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide has a molecular weight of 254.37 g/mol, XLogP of 1.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-2,2-dimethyl-N-(oxolan-3-ylmethyl)butanamide is sourced from PubChem (CID 114285592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).