2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine

C19H37NO — CID 106200788

IUPAC2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine
SMILESCCNC1CCCCCCCCCCC1OCCC1CC1
InChIInChI=1S/C19H37NO/c1-2-20-18-11-9-7-5-3-4-6-8-10-12-19(18)21-16-15-17-13-14-17/h17-20H,2-16H2,1H3
InChIKeyVRSYNOKRKAQQJX-UHFFFAOYSA-N
MW295.51 g/mol
LogP5.06
Rot. Bonds6

About 2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine

2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine (PubChem CID 106200788) has the molecular formula C19H37NO and a molecular weight of 295.51 g/mol. Its IUPAC name is 2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine.

Molecular Properties

Compound Name2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine
PubChem CID106200788
Molecular FormulaC19H37NO
Molecular Weight295.51 g/mol
Exact Mass295.29
IUPAC Name2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine
SMILESCCNC1CCCCCCCCCCC1OCCC1CC1
InChIInChI=1S/C19H37NO/c1-2-20-18-11-9-7-5-3-4-6-8-10-12-19(18)21-16-15-17-13-14-17/h17-20H,2-16H2,1H3
InChIKeyVRSYNOKRKAQQJX-UHFFFAOYSA-N
XLogP5.06
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.51
LogP ≤ 55.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-cyclopropylethoxy)-N-ethylcyclooctan-1-amine
CID 106200627
2-(2-cyclobutylethoxy)-N-ethylcyclooctan-1-amine
CID 106200977
N-ethyl-2-hexoxycycloheptan-1-amine
CID 55135932
N-ethyl-2-octoxycycloheptan-1-amine
CID 63473760
N-ethyl-2-[(2-methylpropan-2-yl)oxy]cyclododecan-1-amine
CID 63475627
N-ethyl-2-(3,3,3-trifluoropropoxy)cyclopentan-1-amine
CID 82954260
N-ethyl-2-[2-(2-methoxyethoxy)ethoxy]cyclohexan-1-amine
CID 104560797
2-(2-cyclobutylethoxy)-N-ethyl-4-methylcyclohexan-1-amine
CID 114157425
N-ethyl-2-(2-ethylbutoxy)cyclooctan-1-amine
CID 114208332
2-propoxy-N-propylcyclododecan-1-amine
CID 63500356
trans-(1S,2S)-N-ethyl-2-methoxycyclohexan-1-amine
CID 93280859
1-[[(1R)-2-(3-cyclohexylpropoxy)cyclohexyl]amino]butan-2-one
CID 67478242

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine?
The IUPAC name of 2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine (CID 106200788) is 2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine.
What is the SMILES notation for 2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine?
The canonical SMILES for 2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine is CCNC1CCCCCCCCCCC1OCCC1CC1.
What is the InChIKey of 2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine?
The InChIKey is VRSYNOKRKAQQJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H37NO/c1-2-20-18-11-9-7-5-3-4-6-8-10-12-19(18)21-16-15-17-13-14-17/h17-20H,2-16H2,1H3.
What are the key properties of 2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine?
2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine has a molecular weight of 295.51 g/mol, XLogP of 5.06, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine is sourced from PubChem (CID 106200788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).