1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine

C14H28N2 — CID 60985128

IUPAC1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine
SMILESCN(CC1CC1)C1(CN)CCCCCCC1
InChIInChI=1S/C14H28N2/c1-16(11-13-7-8-13)14(12-15)9-5-3-2-4-6-10-14/h13H,2-12,15H2,1H3
InChIKeyITZRJNXYYDIMMI-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.77
Rot. Bonds4

About 1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine

1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine (PubChem CID 60985128) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine
PubChem CID60985128
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine
SMILESCN(CC1CC1)C1(CN)CCCCCCC1
InChIInChI=1S/C14H28N2/c1-16(11-13-7-8-13)14(12-15)9-5-3-2-4-6-10-14/h13H,2-12,15H2,1H3
InChIKeyITZRJNXYYDIMMI-UHFFFAOYSA-N
XLogP2.77
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(aminomethyl)-N-(cyclohexylmethyl)-N-methylcyclobutan-1-amine
CID 79521344
1-(aminomethyl)-N-methyl-N-(oxolan-3-ylmethyl)cycloheptan-1-amine
CID 62008518
4-(aminomethyl)-N-(cyclopropylmethyl)-N-methyloxan-4-amine
CID 60984888
1-(aminomethyl)-N-methyl-N-(oxan-3-ylmethyl)cyclooctan-1-amine
CID 63726971
4-(aminomethyl)-N-(cyclopentylmethyl)-N-methyloxepan-4-amine
CID 65079226
1-(aminomethyl)-N-methyl-N-[(2-methylcyclopropyl)methyl]cycloheptan-1-amine
CID 63879073
3-(aminomethyl)-N-(cyclohexylmethyl)-N-methylthian-3-amine
CID 62873285
1-(aminomethyl)-N-(cyclohexylmethyl)-N-methyl-4-(trifluoromethyl)cyclohexan-1-amine
CID 64755111
3-(aminomethyl)-N-(cyclobutylmethyl)-N-methyl-1,1-dioxothiolan-3-amine
CID 63162457
1-(aminomethyl)-N-(cyclopentylmethyl)-N-methyl-4-propylcyclohexan-1-amine
CID 63631397
1-(aminomethyl)-N-(cyclobutylmethyl)-N-methyl-4-propylcyclohexan-1-amine
CID 62861295
4-(aminomethyl)-N-(cyclopentylmethyl)-1-ethyl-N-methylazepan-4-amine
CID 65075624

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine (CID 60985128) is 1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine is CN(CC1CC1)C1(CN)CCCCCCC1.
What is the InChIKey of 1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine?
The InChIKey is ITZRJNXYYDIMMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-16(11-13-7-8-13)14(12-15)9-5-3-2-4-6-10-14/h13H,2-12,15H2,1H3.
What are the key properties of 1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine?
1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine has a molecular weight of 224.39 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(cyclopropylmethyl)-N-methylcyclooctan-1-amine is sourced from PubChem (CID 60985128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).