2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine

C11H23NO — CID 13109464

IUPAC2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine
SMILESCC(C)NC1(OC(C)C)CC1(C)C
InChIInChI=1S/C11H23NO/c1-8(2)12-11(13-9(3)4)7-10(11,5)6/h8-9,12H,7H2,1-6H3
InChIKeyWMQIAHRXDNTBRI-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.54
Rot. Bonds4

About 2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine

2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine (PubChem CID 13109464) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine
PubChem CID13109464
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine
SMILESCC(C)NC1(OC(C)C)CC1(C)C
InChIInChI=1S/C11H23NO/c1-8(2)12-11(13-9(3)4)7-10(11,5)6/h8-9,12H,7H2,1-6H3
InChIKeyWMQIAHRXDNTBRI-UHFFFAOYSA-N
XLogP2.54
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-fluoro-N-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]propan-1-amine
CID 172349736
1-methoxy-2,2-dimethyl-N-propan-2-ylcyclopropan-1-amine
CID 13109456
2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]cyclopropyl]methyl]propan-2-amine
CID 70930249
N-(3-methylbutan-2-yl)-3-propan-2-yloxiran-2-amine
CID 90877172
N-[[1-(ethoxymethyl)cyclopropyl]methyl]propan-2-amine
CID 103984709
N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine
CID 103984710
N,3-di(propan-2-yl)oxiran-2-amine
CID 129172510
N,N'-di(propan-2-yl)-1-propan-2-yloxybutane-1,4-diamine
CID 155605599
N-[[1-(propan-2-yloxymethyl)cyclopropyl]methyl]propan-2-amine
CID 169289958
N-[1-(4-methoxypentan-2-yloxy)ethyl]-3,3-dimethylbutan-2-amine
CID 169879496
N-[(2R)-butan-2-yl]-3-propan-2-yloxiran-2-amine
CID 170286838
N-ethyl-1-methoxy-2,2-dimethylcyclopropan-1-amine
CID 13109462

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine?
The IUPAC name of 2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine (CID 13109464) is 2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine is CC(C)NC1(OC(C)C)CC1(C)C.
What is the InChIKey of 2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine?
The InChIKey is WMQIAHRXDNTBRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-8(2)12-11(13-9(3)4)7-10(11,5)6/h8-9,12H,7H2,1-6H3.
What are the key properties of 2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine?
2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine has a molecular weight of 185.31 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-propan-2-yl-1-propan-2-yloxycyclopropan-1-amine is sourced from PubChem (CID 13109464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).