(4-propylpiperidin-4-yl)methylcarbamic acid

C10H20N2O2 — CID 118239545

IUPAC(4-propylpiperidin-4-yl)methylcarbamic acid
SMILESCCCC1(CNC(=O)O)CCNCC1
InChIInChI=1S/C10H20N2O2/c1-2-3-10(8-12-9(13)14)4-6-11-7-5-10/h11-12H,2-8H2,1H3,(H,13,14)
InChIKeyMGZIWRRPNJUGNE-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.42
Rot. Bonds4

About (4-propylpiperidin-4-yl)methylcarbamic acid

(4-propylpiperidin-4-yl)methylcarbamic acid (PubChem CID 118239545) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is (4-propylpiperidin-4-yl)methylcarbamic acid.

Molecular Properties

Compound Name(4-propylpiperidin-4-yl)methylcarbamic acid
PubChem CID118239545
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name(4-propylpiperidin-4-yl)methylcarbamic acid
SMILESCCCC1(CNC(=O)O)CCNCC1
InChIInChI=1S/C10H20N2O2/c1-2-3-10(8-12-9(13)14)4-6-11-7-5-10/h11-12H,2-8H2,1H3,(H,13,14)
InChIKeyMGZIWRRPNJUGNE-UHFFFAOYSA-N
XLogP1.42
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[(4-propylpiperidin-4-yl)methyl]cyclopropane-1-carboxamide
CID 114280588
ethyl N-[(1-propylcyclopropyl)methyl]carbamate
CID 103762312
1-propan-2-yl-3-[(1-propylcyclopropyl)methyl]urea
CID 103761309
3-piperidin-4-yloxy-N-[(1-propylcyclopropyl)methyl]propanamide
CID 103920742
N-[[1-(dimethylamino)cyclopentyl]methyl]-4-propylpiperidine-4-carboxamide
CID 83112493
2-[1-[[(4-ethylpiperidine-4-carbonyl)amino]methyl]cyclobutyl]acetic acid
CID 81161716
[1-(hydroxymethyl)cyclopentyl]methylcarbamic acid
CID 66597374
N-[(3-propylpyrrolidin-3-yl)methyl]cyclopropanamine
CID 63143322
5-methyl-N-[(4-propylpiperidin-4-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 114280635
tert-butyl N-[[4-(hydroxymethyl)piperidin-4-yl]methyl]carbamate;hydrochloride
CID 163332476
N-[(1-propylcyclopropyl)methyl]benzamide
CID 103762150
[1-(aminomethyl)cyclopropyl]methylcarbamic acid
CID 89477777

Frequently Asked Questions

What is the IUPAC name of (4-propylpiperidin-4-yl)methylcarbamic acid?
The IUPAC name of (4-propylpiperidin-4-yl)methylcarbamic acid (CID 118239545) is (4-propylpiperidin-4-yl)methylcarbamic acid.
What is the SMILES notation for (4-propylpiperidin-4-yl)methylcarbamic acid?
The canonical SMILES for (4-propylpiperidin-4-yl)methylcarbamic acid is CCCC1(CNC(=O)O)CCNCC1.
What is the InChIKey of (4-propylpiperidin-4-yl)methylcarbamic acid?
The InChIKey is MGZIWRRPNJUGNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-2-3-10(8-12-9(13)14)4-6-11-7-5-10/h11-12H,2-8H2,1H3,(H,13,14).
What are the key properties of (4-propylpiperidin-4-yl)methylcarbamic acid?
(4-propylpiperidin-4-yl)methylcarbamic acid has a molecular weight of 200.28 g/mol, XLogP of 1.42, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-propylpiperidin-4-yl)methylcarbamic acid is sourced from PubChem (CID 118239545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).