2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine

C12H25NO — CID 21034317

IUPAC2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine
SMILESCC(C)CN(CC1CCOC1)C(C)C
InChIInChI=1S/C12H25NO/c1-10(2)7-13(11(3)4)8-12-5-6-14-9-12/h10-12H,5-9H2,1-4H3
InChIKeyUFYOUSQAWATXNP-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.39
Rot. Bonds5

About 2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine

2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine (PubChem CID 21034317) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine
PubChem CID21034317
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine
SMILESCC(C)CN(CC1CCOC1)C(C)C
InChIInChI=1S/C12H25NO/c1-10(2)7-13(11(3)4)8-12-5-6-14-9-12/h10-12H,5-9H2,1-4H3
InChIKeyUFYOUSQAWATXNP-UHFFFAOYSA-N
XLogP2.39
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclobutylmethyl)-2-methyl-N-propan-2-ylpropan-1-amine
CID 121474434
3-[[(3S)-oxolan-3-yl]methyl-propan-2-ylamino]propanamide
CID 95136369
N-ethyl-3-[[2-methylpropyl(propan-2-yl)amino]methyl]oxan-4-amine
CID 103059669
2-[2-methylpropyl(propan-2-yl)amino]-1-(oxolan-3-yl)ethanol
CID 104752686
N-(oxan-3-ylmethyl)-N-propan-2-ylpropan-1-amine
CID 163259274
1-N-methyl-1-N-(oxolan-3-ylmethyl)propane-1,2-diamine
CID 63760483
N-(oxepan-3-ylmethyl)-N-propan-2-ylpropan-1-amine
CID 163258033
N-(oxan-3-ylmethyl)-N-(piperidin-4-ylmethyl)propan-2-amine
CID 79716147
N-methyl-4-[[2-methylpropyl(propan-2-yl)amino]methyl]oxolan-3-amine
CID 66245583
5-methyl-1-(oxolan-3-yl)hexan-2-amine
CID 103986842
N'-(2-methylpropyl)-N-(oxolan-3-ylmethyl)-N'-pentan-3-ylethane-1,2-diamine
CID 79490780
N,N-bis(2-methylpropyl)-1-(oxolan-3-yl)ethane-1,2-diamine
CID 61377686

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine?
The IUPAC name of 2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine (CID 21034317) is 2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for 2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine?
The canonical SMILES for 2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine is CC(C)CN(CC1CCOC1)C(C)C.
What is the InChIKey of 2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine?
The InChIKey is UFYOUSQAWATXNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-10(2)7-13(11(3)4)8-12-5-6-14-9-12/h10-12H,5-9H2,1-4H3.
What are the key properties of 2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine?
2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine has a molecular weight of 199.34 g/mol, XLogP of 2.39, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(oxolan-3-ylmethyl)-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 21034317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).