2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine

C14H30N2O — CID 114112993

IUPAC2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine
SMILESCCC(CC)(CN)CNCC1(CCOC)CC1
InChIInChI=1S/C14H30N2O/c1-4-13(5-2,10-15)11-16-12-14(6-7-14)8-9-17-3/h16H,4-12,15H2,1-3H3
InChIKeyHZMFYTUZSDTCPE-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.16
Rot. Bonds10

About 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine

2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine (PubChem CID 114112993) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine.

Molecular Properties

Compound Name2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine
PubChem CID114112993
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine
SMILESCCC(CC)(CN)CNCC1(CCOC)CC1
InChIInChI=1S/C14H30N2O/c1-4-13(5-2,10-15)11-16-12-14(6-7-14)8-9-17-3/h16H,4-12,15H2,1-3H3
InChIKeyHZMFYTUZSDTCPE-UHFFFAOYSA-N
XLogP2.16
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-3,3-dimethylbutan-1-amine
CID 102672590
1-[1-(2-methoxyethyl)cyclobutyl]-N-methylmethanamine
CID 65194306
2-methoxy-N-[[1-(2-methoxyethyl)cyclohexyl]methyl]ethanamine
CID 62723578
1-(4-ethylpiperidin-4-yl)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]methanamine
CID 114113003
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-1-(2,4,6-trimethylphenyl)methanamine
CID 103802368
ethane;[1-(2-methoxyethyl)cyclobutyl]methanamine
CID 156798324
N-[(1-hexylcyclopropyl)methyl]-2-methoxyethanamine
CID 66026488
2-methoxy-N-[[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclobutyl]methyl]ethanamine
CID 104566649
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-1-[2-(trifluoromethyl)phenyl]methanamine
CID 103802421
3-[[[1-(2-methoxyethyl)cyclopropyl]methylamino]methyl]-2-methylaniline
CID 114112981
1-(furan-3-yl)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]methanamine
CID 115735952
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-1-thiophen-3-ylmethanamine
CID 115735920

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine?
The IUPAC name of 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine (CID 114112993) is 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine.
What is the SMILES notation for 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine?
The canonical SMILES for 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine is CCC(CC)(CN)CNCC1(CCOC)CC1.
What is the InChIKey of 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine?
The InChIKey is HZMFYTUZSDTCPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-4-13(5-2,10-15)11-16-12-14(6-7-14)8-9-17-3/h16H,4-12,15H2,1-3H3.
What are the key properties of 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine?
2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine has a molecular weight of 242.41 g/mol, XLogP of 2.16, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine is sourced from PubChem (CID 114112993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).