1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol

C13H28N2O — CID 65211000

IUPAC1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol
SMILESCCN(CC)CC(C)NCC1(O)CCCC1
InChIInChI=1S/C13H28N2O/c1-4-15(5-2)10-12(3)14-11-13(16)8-6-7-9-13/h12,14,16H,4-11H2,1-3H3
InChIKeyBFYDJLKDOJCYEO-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.61
Rot. Bonds7

About 1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol

1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol (PubChem CID 65211000) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol
PubChem CID65211000
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol
SMILESCCN(CC)CC(C)NCC1(O)CCCC1
InChIInChI=1S/C13H28N2O/c1-4-15(5-2)10-12(3)14-11-13(16)8-6-7-9-13/h12,14,16H,4-11H2,1-3H3
InChIKeyBFYDJLKDOJCYEO-UHFFFAOYSA-N
XLogP1.61
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(hexan-2-ylamino)methyl]cyclopentan-1-ol
CID 65105584
1-[(1-hydroxypropan-2-ylamino)methyl]cyclobutan-1-ol
CID 130502696
1-[(1-methoxypropan-2-ylamino)methyl]cyclopentan-1-ol
CID 65107675
1-[(nonan-2-ylamino)methyl]cyclopentan-1-ol
CID 65105272
N'-hydroxy-3-[(1-hydroxycycloheptyl)methylamino]butanimidamide
CID 77056752
ethyl 3-[(1-hydroxycycloheptyl)methylamino]butanoate
CID 65122002
N-ethyl-2-[(1-hydroxycyclopentyl)methylamino]-N-methylpropanamide
CID 103108861
1-[[[1-(dimethylamino)-3-methylbutan-2-yl]amino]methyl]cycloheptan-1-ol
CID 54954236
1-[(1-methylsulfonylpropan-2-ylamino)methyl]cycloheptan-1-ol
CID 64643391
1-[(4-methoxybutan-2-ylamino)methyl]cycloheptan-1-ol
CID 64604658
methyl 3-[(1-hydroxycycloheptyl)methylamino]butanoate
CID 65122312
2-[(1-hydroxycyclopentyl)methylamino]propanoic acid
CID 65108936

Frequently Asked Questions

What is the IUPAC name of 1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol (CID 65211000) is 1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol is CCN(CC)CC(C)NCC1(O)CCCC1.
What is the InChIKey of 1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol?
The InChIKey is BFYDJLKDOJCYEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-4-15(5-2)10-12(3)14-11-13(16)8-6-7-9-13/h12,14,16H,4-11H2,1-3H3.
What are the key properties of 1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol?
1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol has a molecular weight of 228.38 g/mol, XLogP of 1.61, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[1-(diethylamino)propan-2-ylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 65211000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).