4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine

C11H22N2O — CID 60984888

IUPAC4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine
SMILESCN(CC1CC1)C1(CN)CCOCC1
InChIInChI=1S/C11H22N2O/c1-13(8-10-2-3-10)11(9-12)4-6-14-7-5-11/h10H,2-9,12H2,1H3
InChIKeyIEEVXUGFTFQDQS-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.84
Rot. Bonds4

About 4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine

4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine (PubChem CID 60984888) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine
PubChem CID60984888
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine
SMILESCN(CC1CC1)C1(CN)CCOCC1
InChIInChI=1S/C11H22N2O/c1-13(8-10-2-3-10)11(9-12)4-6-14-7-5-11/h10H,2-9,12H2,1H3
InChIKeyIEEVXUGFTFQDQS-UHFFFAOYSA-N
XLogP0.84
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(aminomethyl)-N-(cyclopentylmethyl)-N-methyloxepan-4-amine
CID 65079226
3-(aminomethyl)-N-(cyclopentylmethyl)-N-methyloxolan-3-amine
CID 63630516
1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine
CID 60985128
1-(aminomethyl)-N,3-dimethyl-N-(oxan-4-ylmethyl)cyclopentan-1-amine
CID 64500110
1-(aminomethyl)-N-(cyclohexylmethyl)-N-methylcyclobutan-1-amine
CID 79521344
1-(aminomethyl)-N-methyl-N-(oxolan-3-ylmethyl)cycloheptan-1-amine
CID 62008518
1-(aminomethyl)-N-methyl-N-(oxan-3-ylmethyl)cyclooctan-1-amine
CID 63726971
N-[[4-(aminomethyl)oxan-4-yl]methyl]-1-cyclopropyl-N-methylmethanamine
CID 62391316
1-(aminomethyl)-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 63233140
1-(aminomethyl)-N-(cyclopentylmethyl)-N-methyl-4-propylcyclohexan-1-amine
CID 63631397
1-(aminomethyl)-N-(cyclobutylmethyl)-N-methyl-4-propylcyclohexan-1-amine
CID 62861295
3-(aminomethyl)-N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-amine
CID 55175188

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine?
The IUPAC name of 4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine (CID 60984888) is 4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine.
What is the SMILES notation for 4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine?
The canonical SMILES for 4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine is CN(CC1CC1)C1(CN)CCOCC1.
What is the InChIKey of 4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine?
The InChIKey is IEEVXUGFTFQDQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-13(8-10-2-3-10)11(9-12)4-6-14-7-5-11/h10H,2-9,12H2,1H3.
What are the key properties of 4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine?
4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine has a molecular weight of 198.31 g/mol, XLogP of 0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine is sourced from PubChem (CID 60984888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).