N-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine

C14H30N2 — CID 115726252

IUPACN-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine
SMILESCCCN(CC)CCNC(C)CC1CCC1
InChIInChI=1S/C14H30N2/c1-4-10-16(5-2)11-9-15-13(3)12-14-7-6-8-14/h13-15H,4-12H2,1-3H3
InChIKeyGQYCYAYIDGYENH-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.89
Rot. Bonds9

About N-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine

N-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine (PubChem CID 115726252) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is N-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine.

Molecular Properties

Compound NameN-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine
PubChem CID115726252
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC NameN-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine
SMILESCCCN(CC)CCNC(C)CC1CCC1
InChIInChI=1S/C14H30N2/c1-4-10-16(5-2)11-9-15-13(3)12-14-7-6-8-14/h13-15H,4-12H2,1-3H3
InChIKeyGQYCYAYIDGYENH-UHFFFAOYSA-N
XLogP2.89
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyclopropylethyl)-N'-ethyl-N'-propylethane-1,2-diamine
CID 62573810
N-(1-cyclobutylpropan-2-yl)-N',N'-dimethylpropane-1,3-diamine
CID 115705382
2-N,4-N-bis[2-(diethylamino)ethyl]pentane-2,4-diamine
CID 5239027
N-butan-2-yl-N',N'-dipropylethane-1,2-diamine
CID 54809596
N-(1-cyclohexylpropan-2-yl)-N',N'-dimethylpropane-1,3-diamine
CID 165494361
N-(1-cyclobutylpropan-2-yl)but-2-yn-1-amine
CID 115896850
N-(1-cyclopropylethyl)-N'-(cyclopropylmethyl)-N'-propylethane-1,2-diamine
CID 62555040
1-cyclopentyl-N-(2-propan-2-yloxyethyl)propan-2-amine
CID 104584684
N-butan-2-yl-3-(1-cyclobutylpropan-2-ylamino)propanamide
CID 115713176
N-(5-methylhexan-2-yl)-N',N'-dipropylethane-1,2-diamine
CID 62574843
1-cyclopentyl-N-prop-2-ynylpropan-2-amine
CID 115755854
2-cyclopentyl-2-[2-(diethylamino)ethylamino]acetonitrile
CID 62071768

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine?
The IUPAC name of N-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine (CID 115726252) is N-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine.
What is the SMILES notation for N-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine?
The canonical SMILES for N-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine is CCCN(CC)CCNC(C)CC1CCC1.
What is the InChIKey of N-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine?
The InChIKey is GQYCYAYIDGYENH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-4-10-16(5-2)11-9-15-13(3)12-14-7-6-8-14/h13-15H,4-12H2,1-3H3.
What are the key properties of N-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine?
N-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine has a molecular weight of 226.41 g/mol, XLogP of 2.89, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclobutylpropan-2-yl)-N'-ethyl-N'-propylethane-1,2-diamine is sourced from PubChem (CID 115726252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).