2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide

C10H20N2O3 — CID 106298521

IUPAC2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide
SMILESCCC(N)C(=O)NC1(CO)CCOCC1
InChIInChI=1S/C10H20N2O3/c1-2-8(11)9(14)12-10(7-13)3-5-15-6-4-10/h8,13H,2-7,11H2,1H3,(H,12,14)
InChIKeyRWBCWQOLAHVEHB-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.62
Rot. Bonds4

About 2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide

2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide (PubChem CID 106298521) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide.

Molecular Properties

Compound Name2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide
PubChem CID106298521
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide
SMILESCCC(N)C(=O)NC1(CO)CCOCC1
InChIInChI=1S/C10H20N2O3/c1-2-8(11)9(14)12-10(7-13)3-5-15-6-4-10/h8,13H,2-7,11H2,1H3,(H,12,14)
InChIKeyRWBCWQOLAHVEHB-UHFFFAOYSA-N
XLogP-0.62
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[4-(hydroxymethyl)oxan-4-yl]amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 106297591
2-amino-3,3,3-trifluoro-N-[4-(hydroxymethyl)oxan-4-yl]-2-methylpropanamide
CID 106298806
4-[[2-(Tert-butylamino)acetyl]amino]oxane-4-carboxylic acid
CID 115292422
2-[(1-hydroxy-4-methylpentan-2-yl)amino]-N-(oxan-4-yl)acetamide
CID 55179955
(2S)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-3,3-dimethylbutanamide
CID 62520157
2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-4-methoxybutanamide
CID 62520329
(2S)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]propanamide
CID 62520510
(2S)-2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-3-methylbutanamide
CID 62520687
2-amino-N-[3-(hydroxymethyl)pentan-3-yl]pentanamide
CID 62520692
2-amino-N-[3-(hydroxymethyl)pentan-3-yl]butanamide
CID 62520693
2-amino-N-[3-(hydroxymethyl)pentan-3-yl]propanamide
CID 62520880
2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-3-methylbutanamide
CID 62521592

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide?
The IUPAC name of 2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide (CID 106298521) is 2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide.
What is the SMILES notation for 2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide?
The canonical SMILES for 2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide is CCC(N)C(=O)NC1(CO)CCOCC1.
What is the InChIKey of 2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide?
The InChIKey is RWBCWQOLAHVEHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-2-8(11)9(14)12-10(7-13)3-5-15-6-4-10/h8,13H,2-7,11H2,1H3,(H,12,14).
What are the key properties of 2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide?
2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide has a molecular weight of 216.28 g/mol, XLogP of -0.62, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(hydroxymethyl)oxan-4-yl]butanamide is sourced from PubChem (CID 106298521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).