N-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide

C15H30N2O2 — CID 115914511

IUPACN-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide
SMILESCC(C)C1CC(NCCC(=O)NC(C)(C)C)CCO1
InChIInChI=1S/C15H30N2O2/c1-11(2)13-10-12(7-9-19-13)16-8-6-14(18)17-15(3,4)5/h11-13,16H,6-10H2,1-5H3,(H,17,18)
InChIKeyGEWRBKAEAPMIDH-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.08
Rot. Bonds5

About N-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide

N-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide (PubChem CID 115914511) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide.

Molecular Properties

Compound NameN-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide
PubChem CID115914511
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC NameN-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide
SMILESCC(C)C1CC(NCCC(=O)NC(C)(C)C)CCO1
InChIInChI=1S/C15H30N2O2/c1-11(2)13-10-12(7-9-19-13)16-8-6-14(18)17-15(3,4)5/h11-13,16H,6-10H2,1-5H3,(H,17,18)
InChIKeyGEWRBKAEAPMIDH-UHFFFAOYSA-N
XLogP2.08
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-propan-2-yl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide
CID 112559573
2-[(2-propan-2-yloxan-4-yl)amino]ethyl carbamate
CID 83209461
5-[(2-propan-2-yloxan-4-yl)amino]pentan-1-ol
CID 107302829
2,2-dimethyl-3-[(2-propan-2-yloxan-4-yl)amino]propan-1-ol
CID 115359250
4-oxo-4-[(2-propan-2-yloxan-4-yl)amino]butanoic acid
CID 120551271
N-tert-butyl-3-(cyclooctylamino)propanamide
CID 112688516
3-[[(2-propan-2-yloxan-4-yl)amino]methyl]pentan-3-ol
CID 65105820
tert-butyl N-[3-methyl-1-[(2-propan-2-yloxan-4-yl)amino]butan-2-yl]carbamate
CID 103930694
N'-butan-2-yl-N'-methyl-N-(2-propan-2-yloxan-4-yl)ethane-1,2-diamine
CID 103930680
N-(2-cyclopropylpropyl)-2-propan-2-yloxan-4-amine
CID 115914476
N-tert-butyl-3-[(1,1-dioxothiolan-3-yl)amino]propanamide
CID 112688507
N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-2-propan-2-yloxan-4-amine
CID 103931537

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide?
The IUPAC name of N-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide (CID 115914511) is N-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide.
What is the SMILES notation for N-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide?
The canonical SMILES for N-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide is CC(C)C1CC(NCCC(=O)NC(C)(C)C)CCO1.
What is the InChIKey of N-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide?
The InChIKey is GEWRBKAEAPMIDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-11(2)13-10-12(7-9-19-13)16-8-6-14(18)17-15(3,4)5/h11-13,16H,6-10H2,1-5H3,(H,17,18).
What are the key properties of N-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide?
N-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide has a molecular weight of 270.42 g/mol, XLogP of 2.08, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-[(2-propan-2-yloxan-4-yl)amino]propanamide is sourced from PubChem (CID 115914511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).