N,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane

C11H27NO — CID 155689361

IUPACN,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane
SMILESCC.CC(C)OCCC(C)N(C)C
InChIInChI=1S/C9H21NO.C2H6/c1-8(2)11-7-6-9(3)10(4)5;1-2/h8-9H,6-7H2,1-5H3;1-2H3
InChIKeyRMJSCHRGSBPPSJ-UHFFFAOYSA-N
MW189.34 g/mol
LogP2.78
Rot. Bonds5

About N,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane

N,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane (PubChem CID 155689361) has the molecular formula C11H27NO and a molecular weight of 189.34 g/mol. Its IUPAC name is N,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane.

Molecular Properties

Compound NameN,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane
PubChem CID155689361
Molecular FormulaC11H27NO
Molecular Weight189.34 g/mol
Exact Mass189.21
IUPAC NameN,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane
SMILESCC.CC(C)OCCC(C)N(C)C
InChIInChI=1S/C9H21NO.C2H6/c1-8(2)11-7-6-9(3)10(4)5;1-2/h8-9H,6-7H2,1-5H3;1-2H3
InChIKeyRMJSCHRGSBPPSJ-UHFFFAOYSA-N
XLogP2.78
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.34
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-Dimethyl-3-butoxypropylamine
CID 547393
N,N-Dimethyl-3-isopropoxypropylamine
CID 547394
Dimethylaminopropylather
CID 129648688
[(1S,2S)-2-butoxycyclopropyl]-trimethylazanium
CID 46749
3-ethoxy-N,N-dimethylbutan-1-amine
CID 12572546
3-[4-(dimethylamino)butan-2-yloxy]-N,N-dimethylbutan-1-amine
CID 19362275
3-ethoxy-N,N-di(propan-2-yl)propan-1-amine
CID 20165447
4-[3-(dimethylamino)butoxy]-N,N-dimethylbutan-2-amine
CID 20257332
N,N-diethyl-3-propan-2-yloxypropan-1-amine
CID 20742864
4-ethoxy-N-methyl-N-propan-2-ylbutan-2-amine
CID 22975503
4-methoxy-N-methyl-N-propan-2-ylbutan-2-amine
CID 22975530
3-methoxy-N,N-di(propan-2-yl)propan-1-amine
CID 22975540

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane?
The IUPAC name of N,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane (CID 155689361) is N,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane.
What is the SMILES notation for N,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane?
The canonical SMILES for N,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane is CC.CC(C)OCCC(C)N(C)C.
What is the InChIKey of N,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane?
The InChIKey is RMJSCHRGSBPPSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO.C2H6/c1-8(2)11-7-6-9(3)10(4)5;1-2/h8-9H,6-7H2,1-5H3;1-2H3.
What are the key properties of N,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane?
N,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane has a molecular weight of 189.34 g/mol, XLogP of 2.78, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-propan-2-yloxybutan-2-amine;ethane is sourced from PubChem (CID 155689361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).