N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine

C11H21NO — CID 104871472

IUPACN-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine
SMILESCOC1CC(NCC2CC2(C)C)C1
InChIInChI=1S/C11H21NO/c1-11(2)6-8(11)7-12-9-4-10(5-9)13-3/h8-10,12H,4-7H2,1-3H3
InChIKeyDYQHPJNTLINMIG-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.80
Rot. Bonds4

About N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine

N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine (PubChem CID 104871472) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine.

Molecular Properties

Compound NameN-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine
PubChem CID104871472
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine
SMILESCOC1CC(NCC2CC2(C)C)C1
InChIInChI=1S/C11H21NO/c1-11(2)6-8(11)7-12-9-4-10(5-9)13-3/h8-10,12H,4-7H2,1-3H3
InChIKeyDYQHPJNTLINMIG-UHFFFAOYSA-N
XLogP1.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-ethylcyclohexyl)methyl]-3-methoxycyclobutan-1-amine
CID 104871436
3-methoxy-N-[(1-methylpyrrolidin-2-yl)methyl]cyclobutan-1-amine
CID 104871157
N-[(2,2-dimethylcyclopropyl)methyl]-3-ethylcyclohexan-1-amine
CID 103699452
3-methoxy-N-[(3-methylcyclohexyl)methyl]cyclobutan-1-amine
CID 104589902
3-methoxy-N-pent-4-ynylcyclobutan-1-amine
CID 104871850
N-(3,3-dimethylbutyl)-3-methoxycyclobutan-1-amine
CID 104870848
N-hexyl-3-methoxycyclobutan-1-amine
CID 104870767
N-[(2,2-dimethylcyclopropyl)methyl]-3-(trifluoromethyl)cyclohexan-1-amine
CID 102609637
3-ethoxy-1-[[(3-methoxycyclobutyl)amino]methyl]-2,2-dimethylcyclobutan-1-amine
CID 114119860
5-[(3-methoxycyclobutyl)amino]pentan-1-ol
CID 107316808
N-(2,2-dimethylbutyl)-3-methoxycyclobutan-1-amine
CID 104588064
N-(2-bromoprop-2-enyl)-3-methoxycyclobutan-1-amine
CID 104871443

Frequently Asked Questions

What is the IUPAC name of N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine?
The IUPAC name of N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine (CID 104871472) is N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine.
What is the SMILES notation for N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine?
The canonical SMILES for N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine is COC1CC(NCC2CC2(C)C)C1.
What is the InChIKey of N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine?
The InChIKey is DYQHPJNTLINMIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-11(2)6-8(11)7-12-9-4-10(5-9)13-3/h8-10,12H,4-7H2,1-3H3.
What are the key properties of N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine?
N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine has a molecular weight of 183.29 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,2-dimethylcyclopropyl)methyl]-3-methoxycyclobutan-1-amine is sourced from PubChem (CID 104871472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).