4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide

C14H28N2O2 — CID 114157820

IUPAC4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide
SMILESCC(C)NC(C)(CC(C)OCCC1CC1)C(N)=O
InChIInChI=1S/C14H28N2O2/c1-10(2)16-14(4,13(15)17)9-11(3)18-8-7-12-5-6-12/h10-12,16H,5-9H2,1-4H3,(H2,15,17)
InChIKeyXVACJNWNNYMWRV-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.82
Rot. Bonds9

About 4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide

4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide (PubChem CID 114157820) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide.

Molecular Properties

Compound Name4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide
PubChem CID114157820
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide
SMILESCC(C)NC(C)(CC(C)OCCC1CC1)C(N)=O
InChIInChI=1S/C14H28N2O2/c1-10(2)16-14(4,13(15)17)9-11(3)18-8-7-12-5-6-12/h10-12,16H,5-9H2,1-4H3,(H2,15,17)
InChIKeyXVACJNWNNYMWRV-UHFFFAOYSA-N
XLogP1.82
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanoate
CID 106204438
4-ethoxy-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64707210
ethyl 4-(2-cyclopropylethoxy)-2-methyl-2-(methylamino)pentanoate
CID 106204345
2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide
CID 64706325
4-(2-cyclobutylethoxy)-2-methyl-2-(methylamino)pentanoic acid
CID 106204603
5-(2-cyclobutylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide
CID 106204688
4-(2-cyclobutylethoxy)-2-methyl-2-(propylamino)pentanoic acid
CID 106204642
4-(cyclopentylmethoxy)-2-methyl-2-(propan-2-ylamino)butanamide
CID 66324174
ethyl 5-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanoate
CID 106204394
4-(2-methoxyethoxy)-2-methyl-2-(methylamino)pentanamide
CID 64707377
methyl 2-(2-cyclobutylethoxy)propanoate
CID 106199364
4-(2-cyclopropylethoxy)-2-methyl-2-(methylamino)butanamide
CID 106204321

Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide?
The IUPAC name of 4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide (CID 114157820) is 4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide.
What is the SMILES notation for 4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide?
The canonical SMILES for 4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide is CC(C)NC(C)(CC(C)OCCC1CC1)C(N)=O.
What is the InChIKey of 4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide?
The InChIKey is XVACJNWNNYMWRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-10(2)16-14(4,13(15)17)9-11(3)18-8-7-12-5-6-12/h10-12,16H,5-9H2,1-4H3,(H2,15,17).
What are the key properties of 4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide?
4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide has a molecular weight of 256.39 g/mol, XLogP of 1.82, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide is sourced from PubChem (CID 114157820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).