2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride

C13H27ClN2O2 — CID 119746358

IUPAC2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)N(C)CC1CCCCO1.Cl
InChIInChI=1S/C13H26N2O2.ClH/c1-4-8-13(2,14)12(16)15(3)10-11-7-5-6-9-17-11;/h11H,4-10,14H2,1-3H3;1H
InChIKeyNWXSEQBYCBVAOE-UHFFFAOYSA-N
MW278.82 g/mol
LogP1.95
Rot. Bonds5

About 2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride

2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride (PubChem CID 119746358) has the molecular formula C13H27ClN2O2 and a molecular weight of 278.82 g/mol. Its IUPAC name is 2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride
PubChem CID119746358
Molecular FormulaC13H27ClN2O2
Molecular Weight278.82 g/mol
Exact Mass278.18
IUPAC Name2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)N(C)CC1CCCCO1.Cl
InChIInChI=1S/C13H26N2O2.ClH/c1-4-8-13(2,14)12(16)15(3)10-11-7-5-6-9-17-11;/h11H,4-10,14H2,1-3H3;1H
InChIKeyNWXSEQBYCBVAOE-UHFFFAOYSA-N
XLogP1.95
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.82
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(cyclopentylmethyl)-N,2-dimethylpentanamide;hydrochloride
CID 119759251
2-(aminomethyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)butanamide
CID 113270028
3-amino-3-hydroxyimino-N,2,2-trimethyl-N-(oxan-2-ylmethyl)propanamide
CID 76921233
N,2-dimethyl-N-(oxan-2-ylmethyl)-2-piperidin-3-ylpropanamide
CID 83031069
2-amino-2-methyl-N-(oxolan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pentanamide
CID 60936821
2-methyl-2-[methyl(oxan-2-ylmethyl)amino]propanoic acid
CID 61434067
3-amino-1-methyl-1-(oxan-2-ylmethyl)urea
CID 61436031
2-methyl-2-[methyl(oxan-2-ylmethyl)amino]butanoic acid
CID 114996677
N-methyl-N-(oxan-2-ylmethyl)cyclopropanecarboxamide
CID 61150958
2-[carboxymethyl-[methyl(oxan-2-ylmethyl)carbamoyl]amino]acetic acid
CID 63645794
N-methyl-N-(oxolan-2-ylmethyl)carbamoyl chloride
CID 79887071
2-amino-N,2-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pentanamide
CID 63234440

Frequently Asked Questions

What is the IUPAC name of 2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride?
The IUPAC name of 2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride (CID 119746358) is 2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride is CCCC(C)(N)C(=O)N(C)CC1CCCCO1.Cl.
What is the InChIKey of 2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride?
The InChIKey is NWXSEQBYCBVAOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2.ClH/c1-4-8-13(2,14)12(16)15(3)10-11-7-5-6-9-17-11;/h11H,4-10,14H2,1-3H3;1H.
What are the key properties of 2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride?
2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride has a molecular weight of 278.82 g/mol, XLogP of 1.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,2-dimethyl-N-(oxan-2-ylmethyl)pentanamide;hydrochloride is sourced from PubChem (CID 119746358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).